⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2414 | 0.80 | — | — | |
| SCHEMBL20258259 | 0.75 | — | — | |
| SCHEMBL28612594 | 0.75 | — | — | |
| Ethylene SCHEMBL29279215 | 0.75 | CA1 (0.30) | — | |
| SCHEMBL23309783 | 0.75 | — | — | |
| Ethylene SCHEMBL23706486 | 0.75 | — | — | |
| Water SCHEMBL15538230 | 0.75 | — | — | |
| SCHEMBL20696084 | 0.75 | — | — | |
| SCHEMBL19469325 | 0.75 | — | — | |
| SCHEMBL20957485 | 0.75 | — | — |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102712636-B | Compounds and compositions as TLR activity modulators | IRM LLC | 2014-11-05 | — | — | CN | claimed |
| CN-106132947-B | Process for the preparation of compounds | VPS-3有限公司 | 2019-08-09 | — | — | CN | disclosed |
| CN-109678791-A | The fluoro- 2- of 1- (2,4 difluorobenzene) -2,2- two (5- substituted pyridines -2- base) ethyl ketone and preparation method | VPS-3有限公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-108882709-A | 4- ((6- (2- (2, 4-difluorophenyl) -1, 1-difluoro-2-oxoethyl) pyridine-3-yl) oxy) benzonitrile and preparation method thereof | 美国陶氏益农公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-108882708-A | 4- ((6- (2- (2, 4-difluorophenyl) -1, 1-difluoro-2-hydroxy-3- (1H-1,2, 4-triazol-1-yl) propyl) pyridin-3-yl) oxy) benzonitrile and preparation method thereof | 美国陶氏益农公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-108473497-A | Ep4 antagonists | 卫材R&D 管理有限公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-108473443-A | 4- ((6- (2- (2, 4-difluorophenyl) -1, 1-difluoro-2-hydroxy-3- (1H-1,2, 4-triazol-1-yl) propyl) pyridin-3-yl) oxy) benzonitrile and preparation method thereof | 美国陶氏益农公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-108473463-A | 4- ((6- (two fluoro- 2- hydroxyls -3- (1H-1,2,4- triazol-1-yls) propyl of 2- (2,4 difluorobenzene base) -1,1-) pyridin-3-yl) oxygroup) benzonitriles and preparation method | 美国陶氏益农公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-108026050-A | NOVEL COMPOUNDS AS ROR GAMMA MODULATORS | 格兰马克药品股份有限公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-104910161-B | Pyrazolopyrimidine compound and method as JAK inhibitor | 健泰科生物技术公司 | 2018-03-30 | — | — | CN | disclosed |
| CN-105085429-A | Heteroaromatic derivative and application thereof to medicament | GUANGDONG HEC PHARMACEUTICAL | 2015-11-25 | — | — | CN | disclosed |
| US-8921124-B2 | Pyrazole-based cyanine dye | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2014-12-30 | — | — | US | disclosed |
| CN-104245680-A | Process for producing 5- (difluoromethyl) pyrazine-2-carboxylic acid and production intermediate thereof | EISAI R&D MAN CO LTD | 2014-12-24 | — | — | CN | disclosed |
| CN-102712636-B | Compounds and compositions as TLR activity modulators | IRM LLC | 2014-11-05 | — | — | CN | disclosed |
| CN-103502240-A | Azole derivative | TAISHO PHARMACEUTICAL CO LTD | 2014-01-08 | — | — | CN | disclosed |
| CN-103119024-A | Isoquinoline Derivatives | TAISHO PHARMACEUTICAL CO LTD | 2013-05-22 | — | — | CN | disclosed |
| WO-2012033298-A3 | METHOD FOR MANUFACTURING A NOX GAS SENSOR, AND NOX GAS SENSOR MANUFACTURED USING SAME | 일진머티리얼즈 주식회사 (KR) | 2012-05-10 | — | — | WO | disclosed |
| EP-2006289-B1 | PYRAZOLE-TYPE CYANINE DYE | WAKO PURE CHEM IND LTD (JP) | 2011-11-30 | — | — | EP | disclosed |
| US-20090069546-A1 | PYRAZOLE-BASED CYANINE DYE | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2009-03-12 | — | — | US | disclosed |
| EP-2006289-A1 | PYRAZOLE-TYPE CYANINE DYE | Wako Pure Chemical Industries, Ltd. (JP) | 2008-12-24 | — | — | EP | disclosed |