⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29427046 | 1.00 | — | — | |
| SCHEMBL9013848 | 0.88 | L3MBTL1 (0.43) | — | |
| SCHEMBL160602 | 0.82 | BTK (0.47) | — | |
| SCHEMBL6772010 | 0.80 | L3MBTL1 (0.54) | — | |
| SCHEMBL959837 | 0.77 | L3MBTL1 (0.62) | — | |
| SCHEMBL17764765 | 0.76 | — | — | |
| SCHEMBL1763356 | 0.76 | — | — | |
| SCHEMBL9827910 | 0.76 | — | — | |
| SCHEMBL9494178 | 0.76 | CYP3A4 (0.42) | — | |
| SCHEMBL30271358 | 0.76 | MAPK8 (0.49) | — |
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 862 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111151248-A | Method for catalyzing heterocyclic halogen-containing organic matter hydrogenation dehalogenation by using supported metal oxide | 浙江大学 | 2020-05-15 | — | — | CN | claimed |
| CN-105492435-B | Compound as IDH2 mutant inhibitor | 安吉奥斯医药品有限公司 | 2018-06-29 | — | — | CN | claimed |
| CN-102971317-B | tetrahydro-pyrido-pyrimidine derivatives | NOVARTIS AG (CH) | 2016-01-20 | — | — | CN | claimed |
| CN-104918940-A | Purine inhibitors of human phosphatidylinositol 3-kinase | MERCK SHARP & DOHME | 2015-09-16 | — | — | CN | claimed |
| CN-104918939-A | Purine inhibitors of human phosphatidylinositol 3-kinase | MERCK SHARP & DOHME | 2015-09-16 | — | — | CN | claimed |
| CN-104703980-A | Orexin receptor antagonists which are [ortho bi (hetero )aryl]-[2-(meta bi (hetero )aryl)-pyrrolidin-1-yl]-methanone derivatives | ACTELION PHARMACEUTICALS LTD | 2015-06-10 | — | — | CN | claimed |
| CN-102753527-B | Cyclohexyl amide derivatives as crf receptor antagonists | NOVARTIS AG | 2014-12-24 | — | — | CN | claimed |
| CN-101193895-B | Method for producing tricyclic ketone | YAKULT HONSHA KK | 2011-06-01 | — | — | CN | claimed |
| EP-0470171-B1 | POLYMERIZATION PROCESS AND CATALYST | SHELL OIL CO (US) | 1996-12-04 | — | — | EP | claimed |
| EP-0527186-A4 | — | UNIV ILLINOIS (US) | 1995-01-18 | — | — | EP | claimed |
| EP-0470171-A4 | POLYMERIZATION PROCESS AND CATALYST | — | 1992-10-28 | — | — | EP | claimed |
| US-5118768-A | Polymerization in presence of magnesium alkoxide, tetravalent titanium halide, and organoaluminum compound | SHELL OIL COMPANY (US) | 1992-06-02 | — | — | US | claimed |
| US-5118649-A | Reaction product of magnesium alkoxide and tetravalent titanium halide; organoaluminum compound; selectivity control agent | SHELL OIL COMPANY (US) | 1992-06-02 | — | — | US | claimed |
| US-5089573-A | Using coordination catalysts | SHELL OIL COMPANY (US) | 1992-02-18 | — | — | US | claimed |
| EP-0470171-A1 | POLYMERIZATION PROCESS AND CATALYST. | SHELL OIL CO (US) | 1992-02-12 | — | — | EP | claimed |
| WO-1991016820-A1 | PHOTODYNAMIC PLANT DEFOLIANTS AND CHLOROPHYLL BIOSYNTHESIS MODULATORS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 1991-11-14 | — | — | WO | claimed |
| WO-1990012816-A1 | POLYMERIZATION PROCESS AND CATALYST | SHELL OIL COMPANY (US) | 1990-11-01 | — | — | WO | claimed |
| EP-0124657-B1 | METHOD FOR THE PREPARATION OF 3,5,6-TRICHLORO-1H-PYRIDIN-2-ONE | RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) | 1987-03-11 | — | — | EP | claimed |
| US-4546190-A | Method for producing 3,5,6-trichloro-1H-pyridine-2-on | RUTGERSWERKE AKTIENGESELLSCHAFT (DE) | 1985-10-08 | — | — | US | claimed |
| EP-0124657-A1 | Method for the preparation of 3,5,6-trichloro-1H-pyridin-2-one | RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) | 1984-11-14 | — | — | EP | claimed |