⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12631002 | 0.70 | — | — | |
| SCHEMBL625895 | 0.67 | — | — | |
| SCHEMBL8012255 | 0.66 | — | — | |
| SCHEMBL3314392 | 0.64 | — | — | |
| SCHEMBL8723031 | 0.64 | — | — | |
| SCHEMBL28842548 | 0.64 | — | — | |
| SCHEMBL32089673 | 0.55 | GSK3B (0.43) | — | |
| SCHEMBL1081008 | 0.55 | GSK3B (0.43) | — | |
| SCHEMBL3626475 | 0.54 | — | — | |
| SCHEMBL11513403 | 0.54 | — | — |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102227423-B | Fungicidal heterocyclic compounds | DU PONT | 2015-06-17 | — | — | CN | claimed |
| CN-102227423-A | Fungicidal heterocyclic compounds | DU PONT | 2011-10-26 | — | — | CN | claimed |
| JP-6271535-A | — | — | None | — | — | JP | disclosed |
| CN-109688816-A | Active compound combinations and method for protecting plant propagation material | 拜耳作物科学股份公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-109641870-A | Substituted halo (thio) acyl compounds | 拜耳作物科学股份公司 | 2019-04-16 | — | — | CN | disclosed |
| CN-105143223-B | 3- (2- aminopyrimidine -4- base) -5- (3- hydroxypropyl alkynyl) -1H- pyrrolo- [2,3-C] pyridine derivate is used for treating cancer as NIK inhibitor | 詹森药业有限公司 | 2018-11-30 | — | — | CN | disclosed |
| CN-108473396-A | The method of production and purifying 2,3,3,3- tetrafluoro-1-propenes | 阿科玛法国公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-108368008-A | The method of production and purifying 2,3,3,3- tetrafluoro-1-propenes | 阿科玛法国公司 | 2018-08-03 | — | — | CN | disclosed |
| CN-108368009-A | The method for producing 2,3,3,3- tetrafluoropropenes and recycling 1,1,1,2,2- pentafluoropropanes free from foreign meter | 阿科玛法国公司 | 2018-08-03 | — | — | CN | disclosed |
| CN-107848975-A | Nitrogen-containing heterocycles as pesticides | 拜耳作物科学股份公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-107709309-A | The manufacture method of fluorine-containing cyclopropane carboxylic acid acids | 中央硝子株式会社 | 2018-02-16 | — | — | CN | disclosed |
| CN-1107502-C | Preparation method for medicinal composition containing hydrogenated pyridine derivative as active components | SANKYO CO (JP) | 2003-05-07 | — | — | CN | disclosed |
| CN-1217186-A | Preparation method for medicinal composition containing hydrogenated pyridine derivative as active components | SANKYO CO (JP) | 1999-05-26 | — | — | CN | disclosed |
| CN-1107155-A | Thienyl- and furylpyrrole insecticidal and acaridical agents | AMERICAN CYANAMID CO (US) | 1995-08-23 | — | — | CN | disclosed |
| US-5420293-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1995-05-30 | — | — | US | disclosed |
| US-5420293-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1995-05-30 | — | — | US | disclosed |
| US-5420293-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1995-05-30 | — | — | US | disclosed |
| JP-H06271535-A | N-SUBSTITUTED ALPHA-FLUOROALKYL-LACTAMS | BAYER AG | 1994-09-27 | — | — | JP | disclosed |
| EP-0610651-A1 | N-substituted alpha-fluoroalkyllactames | BAYER AG (DE) | 1994-08-17 | — | — | EP | disclosed |
| CN-1040197-A | SUBSTITUTED PHENYLTRIAZOLOPYRIMIDINE HERBICIDES | DU PONT (US) | 1990-03-07 | — | — | CN | disclosed |