⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11249932 | 0.74 | LTA4H (0.43) | — | |
| SCHEMBL29246031 | 0.71 | CYP2A6 (0.50) | — | |
| SCHEMBL16517020 | 0.70 | LTA4H (0.37) | — | |
| SCHEMBL2433738 | 0.65 | — | — | |
| SCHEMBL25360523 | 0.63 | ALDH1A1 (0.40) | — | |
| SCHEMBL218376 | 0.63 | ALDH1A1 (0.40) | — | |
| SCHEMBL1649854 | 0.63 | ALDH1A1 (0.40) | — | |
| SCHEMBL10386287 | 0.61 | TSHR (0.35) | — | |
| Methane SCHEMBL10860324 | 0.60 | ALDH1A1 (0.38) | — | |
| SCHEMBL1563447 | 0.60 | ALDH1A1 (0.38) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116987047-A | Heterocyclic oxime compound, preparation method, application and composition thereof | 贵州大学 | 2023-11-03 | — | — | CN | disclosed |
| CN-108473481-A | compounds useful as kinase inhibitors | 洛克索肿瘤学股份有限公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-104330956-B | The method of photoresist composition, the base material of coating and formation electronic device | 罗门哈斯电子材料有限公司 | 2018-04-10 | — | — | CN | disclosed |
| CN-104327252-B | METHOD OF FORMING POLYARYL POLYMERS | 陶氏环球技术有限公司 | 2017-05-03 | — | — | CN | disclosed |
| CN-103596929-B | Pyrazole and pyrimidine tricycloalkenones as antioxidant inflammation modulators | 里亚塔医药公司 | 2016-10-19 | — | — | CN | disclosed |
| CN-105722836-A | PHARMACEUTICALLY ACCEPTABLE SALTS OF 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS | 埃克希金医药品有限公司 | 2016-06-29 | — | — | CN | disclosed |
| CN-104334545-A | 3,5-diaminopyrazole kinase inhibitors | AXIKIN PHARMACEUTICALS INC | 2015-02-04 | — | — | CN | disclosed |
| CN-104302640-A | 3,5-diaminopyrazole kinase inhibitors | AXIKIN PHARMACEUTICALS INC | 2015-01-21 | — | — | CN | disclosed |
| CN-103965200-A | Substituted Imidazo[1,2b]pyridazine Compounds As Trk Kinase Inhibitors | ARRAY BIOPHARMA INC | 2014-08-06 | — | — | CN | disclosed |
| CN-102224153-B | Substituted imidazo [1,2-B ] pyridazine compounds as TRK kinase inhibitors | ARRAY BIOPHARMA INC | 2014-04-30 | — | — | CN | disclosed |
| CN-103596929-A | Pyrazole and pyrimidine tricycloalkenones as antioxidant inflammation modulators | REATA PHARMACEUTICALS INC | 2014-02-19 | — | — | CN | disclosed |
| CN-102224153-A | Substituted imidazo [1,2-B ] pyridazine compounds as TRK kinase inhibitors | ARRAY BIOPHARMA INC | 2011-10-19 | — | — | CN | disclosed |
| CN-101573364-A | Process for the preparation of 4-hydroxythieno [2, 3-b ] pyridine-5-carbonitriles | WYETH CORP (US) | 2009-11-04 | — | — | CN | disclosed |
| CN-101268039-A | Novel carboxylic acid derivatives | DSM IP ASSETS BV (NL) | 2008-09-17 | — | — | CN | disclosed |
| US-5843931-A | 6,7-modified 11β-aryl-4-oestrenes | SHERING AKTIENGESELLSCHAFT (DE) | 1998-12-01 | — | — | US | disclosed |
| CN-1029398-C | Process for preparing intermediates useful in the synthesis of steroids having optically active side chains | WESONSIN ALUMNI RESEARCH FOUND (US) | 1995-08-02 | — | — | CN | disclosed |
| CN-1048849-A | Preparation is used for synthetic side chain and has the method for the intermediate of optically active steroide | WISCONSIN ALUMNI RES FOUND (US) | 1991-01-30 | — | — | CN | disclosed |