⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16784480 | 0.89 | — | — | |
| SCHEMBL1165185 | 0.73 | KDM4E (0.48) | — | |
| SCHEMBL18580703 | 0.73 | — | — | |
| SCHEMBL1108282 | 0.73 | KDM4E (0.40) | — | |
| SCHEMBL18580300 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL2558506 | 0.72 | UNG (0.36) | — | |
| SCHEMBL18580543 | 0.72 | TYR (0.44) | — | |
| SCHEMBL18580552 | 0.71 | TRIM24 (0.30) | — | |
| SCHEMBL6698447 | 0.71 | ERN1 (0.33) | — | |
| SCHEMBL113201 | 0.71 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112724127-B | Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof | 中国科学院上海药物研究所 | 2023-02-17 | — | — | CN | disclosed |
| US-20230032101-A1 | FIVE-MEMBERED HETEROCYCLIC OXOCARBOXYLIC ACID COMPOUND AND MEDICAL USE THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2023-02-02 | — | — | US | disclosed |
| EP-4053124-A1 | FIVE-MEMBERED HETEROCYCLIC OXOCARBOXYLIC ACID COMPOUND AND MEDICAL USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2022-09-07 | — | — | EP | disclosed |
| CN-114829357-A | Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof | 中国科学院上海药物研究所 | 2022-07-29 | — | — | CN | disclosed |
| CN-107987096-B | Method for synthesizing 2-aldehyde furan-4-boronic acid pinacol ester | 沧州普瑞东方科技有限公司 | 2020-06-05 | — | — | CN | disclosed |
| EP-2123644-B1 | BENZOXAZEPINE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2014-12-17 | — | — | EP | disclosed |
| EP-2019831-B1 | NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS 101 | ASTRAZENECA AB (SE) | 2012-09-12 | — | — | EP | disclosed |
| US-8247403-B2 | Benzoxazepine derivatives and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-08-21 | — | — | US | disclosed |
| US-20110136804-A1 | Nicotinic Acetylcholine Receptor Ligands 101 | ASTRAZENECA AB (SE) | 2011-06-09 | — | — | US | disclosed |
| US-7884124-B2 | such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions | SEPRACOR INC. (US) | 2011-02-08 | — | — | US | disclosed |
| WO-2008005456-A2 | FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE | SEPRACOR INC. (US) | 2008-01-10 | — | — | WO | disclosed |
| US-20080004327-A1 | FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE | SEPRACOR INC. (US) | 2008-01-03 | — | — | US | disclosed |
| US-20080004328-A1 | FUSED HETEROCYCLES | SEPRACOR INC. (US) | 2008-01-03 | — | — | US | disclosed |
| WO-2007133155-A1 | NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS 101 | ASTRAZENECA AB (SE) | 2007-11-22 | — | — | WO | disclosed |
| US-7297795-B2 | Process for preparation of 4-amino-3-quinolinecarbonitriles | WYETH HOLDINGS CORPORATION (US) | 2007-11-20 | — | — | US | disclosed |
| WO-2007109093-A2 | PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF | WYETH (US) | 2007-09-27 | — | — | WO | disclosed |
| US-20070219186-A1 | Pyrazolo[1,5-A]pyrimidine derivatives and methods of use thereof | WYETH (US) | 2007-09-20 | — | — | US | disclosed |
| EP-1660453-A2 | PROCESS FOR THE PREPARATION OF 4-AMINO-3-QUINOLINECARBONITRILES | Wyeth Holdings Corporation (US) | 2006-05-31 | — | — | EP | disclosed |
| WO-2005019201-A2 | PROCESS FOR THE PREPARATION OF 4-AMINO-3-QUINOLINECARBONITRILES | WYETH HOLDINGS CORPORATION (US) | 2005-03-03 | — | — | WO | disclosed |
| US-20050043537-A1 | Process for preparation of 4-amino-3-quinolinecarbonitriles | WYETH HOLDINGS CORPORATION (US) | 2005-02-24 | — | — | US | disclosed |