⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL50071 | 0.71 | — | — | |
| SCHEMBL22594 | 0.71 | — | — | |
| SCHEMBL7955325 | 0.71 | ACHE (0.41) | — | |
| SCHEMBL28898407 | 0.69 | — | — | |
| SCHEMBL5024735 | 0.67 | — | — | |
| SCHEMBL6486360 | 0.67 | — | — | |
| SCHEMBL1029610 | 0.67 | — | — | |
| SCHEMBL10461628 | 0.67 | — | — | |
| SCHEMBL3601381 | 0.67 | — | — | |
| SCHEMBL2889295 | 0.67 | HSD17B1 (0.46) | — |
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 390 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117285451-A | Polysubstituted pyrrole compound and synthetic method and application thereof | 重庆文理学院 | 2023-12-26 | — | — | CN | claimed |
| CN-110229072-B | Synthetic method of tolterodine and enantiomer thereof | 中国药科大学 | 2022-04-08 | — | — | CN | claimed |
| CN-108558723-B | N- (2-isobornenyl) thiosemicarbazone compound and preparation method and application thereof | 南京林业大学 | 2020-02-18 | — | — | CN | claimed |
| US-20180118718-A1 | Substituted Quinoxaline Derivatives | SELVITA S.A. (PL) | 2018-05-03 | — | — | US | claimed |
| EP-3294728-A1 | SUBSTITUTED QUINOXALINE DERIVATIVES | SELVITA S.A. (PL) | 2018-03-21 | — | — | EP | claimed |
| CN-105130995-B | Pyrrolidone compound and its preparation method and application | 杭州成邦医药科技有限公司 | 2017-08-11 | — | — | CN | claimed |
| WO-2016180537-A1 | SUBSTITUTED QUINOXALINE DERIVATIVES | SELVITA S.A. (PL) | 2016-11-17 | — | — | WO | claimed |
| US-9204647-B2 | Pyrazole compounds for controlling invertebrate pests | BASF SE (DE) | 2015-12-08 | — | — | US | claimed |
| EP-2504324-B1 | SULTAM DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2015-02-25 | — | — | EP | claimed |
| US-8852664-B2 | Neo-menthyl derivatives as flavor materials | SYMRISE AG (DE) | 2014-10-07 | — | — | US | claimed |
| EP-0886640-A1 | SIALYL-LEWISa AND SIALYL-LEWISx EPITOPE ANALOGUES | GlycoTech Corp. (US) | 1998-12-30 | — | — | EP | claimed |
| EP-0886639-A1 | SIALYL-LEWISa AND SIALYL-LEWISx EPITOPE ANALOGUES | GlycoTech Corp. (US) | 1998-12-30 | — | — | EP | claimed |
| US-5723413-A | Substituted naphthyridines and their herbicidal use | BASF AKTIENGESELLSCHAFT (DE) | 1998-03-03 | — | — | US | claimed |
| WO-1997028173-A1 | SIALYL-LEWISa AND SIALYL-LEWISx EPITOPE ANALOGUES | NOVARTIS AG (CH) | 1997-08-07 | — | — | WO | claimed |
| WO-1997028174-A1 | SIALYL-LEWISa AND SIALYL-LEWISx EPITOPE ANALOGUES | NOVARTIS AG (CH) | 1997-08-07 | — | — | WO | claimed |
| EP-0787132-A1 | BICYCLIC TETRAHYDRO PYRAZOLOPYRIDINES AND THEIR USE AS MEDICAMENTS | PFIZER INC. (US) | 1997-08-06 | — | — | EP | claimed |
| WO-1996012720-A1 | BICYCLIC TETRAHYDRO PYRAZOLOPYRIDINES AND THEIR USE AS MEDICAMENTS | PFIZER INC. (US) | 1996-05-02 | — | — | WO | claimed |
| EP-0669332-A2 | Substituted naphtyridines and their use as herbicides | BASF Aktiengesellschaft (DE) | 1995-08-30 | — | — | EP | claimed |
| EP-0374952-A2 | 7-Oxabicycloheptyl substituted heterocyclic amide prostaglandin analogs useful in the treatment of thrombotic and vasospastic disease | E.R. SQUIBB & SONS, INC. (US) | 1990-06-27 | — | — | EP | claimed |
| US-4008213-A | WATER INSOLUBLE | UGINE KUHLMANN (FR) | 1977-02-15 | — | — | US | claimed |