⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6836165 | 0.89 | — | — | |
| SCHEMBL1937731 | 0.89 | — | — | |
| SCHEMBL15134457 | 0.79 | — | — | |
| SCHEMBL15134478 | 0.76 | — | — | |
| SCHEMBL15134464 | 0.76 | — | — | |
| SCHEMBL15134465 | 0.73 | — | — | |
| SCHEMBL1600712 | 0.72 | — | — | |
| SCHEMBL5857797 | 0.69 | TSHR (0.35) | — | |
| SCHEMBL15134463 | 0.69 | — | — | |
| SCHEMBL10419616 | 0.69 | — | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111018785-B | Synthesis method and application of 1- (4-chlorphenyl) -3-pyrazole alcohol | 武汉科技大学 | 2022-02-11 | — | — | CN | claimed |
| CN-111018785-A | Synthesis method and application of 1- (4-chlorphenyl) -3-pyrazole alcohol | 武汉科技大学 | 2020-04-17 | — | — | CN | claimed |
| CN-102123981-B | The preparation methods of 6-substituted amino-3-cyanoquinoline and the intermediates thereof | TOPHARMAN SHANGHAI Co.,Ltd. (CN) | 2014-10-01 | — | — | CN | claimed |
| US-8481741-B2 | Preparation methods of 6 substituted amino-3 cyanoquinoline compounds and the intermediates thereof | TOPHARMAN SHANGHAI CO., LTD. (CN) | 2013-07-09 | — | — | US | claimed |
| CN-102731395-A | Intermediate compound of antitumor drug neratinib and its preparation method and use | SHANGHAI INST MATERIA MEDICA | 2012-10-17 | — | — | CN | claimed |
| US-20110263860-A1 | PREPARATION METHODS OF 6-SUBSTITUTED AMINO-3-CYANOQUINOLINE COMPOUNDS AND THE INTERMEDIATES THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2011-10-27 | — | — | US | claimed |
| US-20110245249-A1 | Heterocyclically Substituted Anilinopyrimidines | BAYER CROPSCIENCE AG (DE) | 2011-10-06 | — | — | US | claimed |
| EP-2331533-A1 | HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES | Bayer CropScience AG (DE) | 2011-06-15 | — | — | EP | claimed |
| WO-2010025850-A1 | HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES | BAYER CROPSCIENCE AG (DE) | 2010-03-11 | — | — | WO | claimed |
| CN-111018785-B | Synthesis method and application of 1- (4-chlorphenyl) -3-pyrazole alcohol | 武汉科技大学 | 2022-02-11 | — | — | CN | disclosed |
| US-20200388887-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND ELECTRICAL STORAGE DEVICE INCLUDING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2020-12-10 | — | — | US | disclosed |
| US-20200388884-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND ENERGY DEVICE INCLUDING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2020-12-10 | — | — | US | disclosed |
| CN-111018785-A | Synthesis method and application of 1- (4-chlorphenyl) -3-pyrazole alcohol | 武汉科技大学 | 2020-04-17 | — | — | CN | disclosed |
| US-10573892-B2 | Negative electrode active material and secondary battery including the same | LG CHEM, LTD. (KR) | 2020-02-25 | — | — | US | disclosed |
| CN-102731395-A | Intermediate compound of antitumor drug neratinib and its preparation method and use | SHANGHAI INST MATERIA MEDICA | 2012-10-17 | — | — | CN | disclosed |
| US-20110263860-A1 | PREPARATION METHODS OF 6-SUBSTITUTED AMINO-3-CYANOQUINOLINE COMPOUNDS AND THE INTERMEDIATES THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2011-10-27 | — | — | US | disclosed |
| US-20110245249-A1 | Heterocyclically Substituted Anilinopyrimidines | BAYER CROPSCIENCE AG (DE) | 2011-10-06 | — | — | US | disclosed |
| EP-2331533-A1 | HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES | Bayer CropScience AG (DE) | 2011-06-15 | — | — | EP | disclosed |
| WO-2010025850-A1 | HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES | BAYER CROPSCIENCE AG (DE) | 2010-03-11 | — | — | WO | disclosed |
| US-6919143-B2 | Positive active material composition for lithium-sulfur battery and lithium-sulfur battery fabricated using same | SAMSUNG SDI CO., LTD. (KR) | 2005-07-19 | — | — | US | disclosed |