Heteroaromatic rings of the future

WR Pitt, DM Parry, BG Perry… - Journal of medicinal …, 2009 - ACS Publications
Small aromatic ring systems are of central importance in the development of novel synthetic
protein ligands. Here we generate a complete list of 24847 such ring systems. We call this …

Rings in drugs: Miniperspective

RD Taylor, M MacCoss… - Journal of medicinal …, 2014 - ACS Publications
We have analyzed the rings, ring systems, and frameworks in drugs listed in the FDA
Orange Book to understand the frequency, timelines, molecular property space, and the …

Ring systems in natural products: structural diversity, physicochemical properties, and coverage by synthetic compounds

Y Chen, C Rosenkranz, S Hirte, J Kirchmair - Natural Product Reports, 2022 - pubs.rsc.org
Covering: up to 2021 The structural core of most small-molecule drugs is formed by a ring
system, often derived from natural products. However, despite the importance of natural …

Quest for the rings. In silico exploration of ring universe to identify novel bioactive heteroaromatic scaffolds

P Ertl, S Jelfs, J Mühlbacher… - Journal of medicinal …, 2006 - ACS Publications
Bioactive molecules only contain a relatively limited number of unique ring types. To identify
those ring properties and structural characteristics that are necessary for biological activity, a …

Rings in clinical trials and drugs: present and future

J Shearer, JL Castro, ADG Lawson… - Journal of medicinal …, 2022 - ACS Publications
We present a comprehensive analysis of all ring systems (both heterocyclic and
nonheterocyclic) in clinical trial compounds and FDA-approved drugs. We show 67% of …

Counting on natural products for drug design

T Rodrigues, D Reker, P Schneider, G Schneider - Nature chemistry, 2016 - nature.com
Natural products and their molecular frameworks have a long tradition as valuable starting
points for medicinal chemistry and drug discovery. Recently, there has been a revitalization …

Biomimetic diversity-oriented synthesis of benzannulated medium rings via ring expansion

RA Bauer, TA Wenderski, DS Tan - Nature chemical biology, 2013 - nature.com
Nature has exploited medium-sized 8-to 11-membered rings in a variety of natural products
to address diverse and challenging biological targets. However, owing to the limitations of …

Privileged structures revisited

P Schneider, G Schneider - Angewandte Chemie International …, 2017 - Wiley Online Library
Privileged structures inspire compound library design in medicinal chemistry. We performed
a comprehensive analysis of 1.4 million bioactive compounds, with the aim of assessing the …

New and unusual scaffolds in medicinal chemistry

CM Marson - Chemical Society Reviews, 2011 - pubs.rsc.org
Contemporary medicinal chemistry faces diverse challenges from several directions,
including the need for both potency and specificity of any therapeutic agent; the increasingly …

Charting biologically relevant spirocyclic compound space

G Müller, T Berkenbosch… - … A European Journal, 2017 - Wiley Online Library
Spirocycles frequently occur in natural products and experience increasing interest in drug
discovery, given their richness in sp3 centers and distinct three‐dimensionality. We have …