⚠ 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 | |
|---|---|---|---|---|
| Butane SCHEMBL6847120 | 0.91 | — | — | |
| SCHEMBL3537547 | 0.79 | TSHR (0.35) | — | |
| SCHEMBL7843510 | 0.74 | — | — | |
| SCHEMBL7130267 | 0.74 | — | — | |
| SCHEMBL4447441 | 0.70 | — | — | |
| SCHEMBL29273944 | 0.70 | — | — | |
| Butane SCHEMBL6308269 | 0.70 | — | — | |
| SCHEMBL297052 | 0.69 | — | — | |
| SCHEMBL333601 | 0.69 | — | — | |
| SCHEMBL7934332 | 0.67 | — | — |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117545754-A | Modulators of TREX1 | 星座制药公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-113924092-A | Quinoline and quinazoline compounds and methods of use thereof | 斯汀格瑞治疗股份有限公司 | 2022-01-11 | — | — | CN | disclosed |
| CN-111574464-A | Quinazoline derivatives for the treatment of HIV | 吉利德科学公司 | 2020-08-25 | — | — | CN | disclosed |
| CN-107278201-B | Quinazoline derivatives for the treatment of HIV | 吉利德科学公司 | 2020-05-19 | — | — | CN | disclosed |
| CN-103443080-B | There is the sulfonamide compounds of TRPM8 antagonistic activity | 田边三菱制药株式会社 | 2016-10-12 | — | — | CN | disclosed |
| CN-102365264-B | Process for producing 3-(2-cyano-1-propenyl)-2,2- dimethylcyclopropanecarboxylic acid or salt thereof | SUMITOMO CHEMICAL CO | 2014-05-21 | — | — | CN | disclosed |
| CN-102361851-B | Method for producing cyclopropanecarboxylic acid ester | SUMITOMO CHEMICAL CO | 2014-03-19 | — | — | CN | disclosed |
| CN-103443080-A | Sulfonamide compounds having TRPM8 antagonistic activity | MITSUBISHI TANABE PHARMA CORP | 2013-12-11 | — | — | CN | disclosed |
| EP-1940401-B1 | ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2012-07-11 | — | — | EP | disclosed |
| CN-102365264-A | Process for producing 3-(2-cyano-1-propenyl)-2,2- dimethylcyclopropanecarboxylic acid or salt thereof | SUMITOMO CHEMICAL CO | 2012-02-29 | — | — | CN | disclosed |
| CN-101605795-A | Tricyclic compounds and pharmaceutical uses thereof | TAKEDA PHARMACEUTICAL (JP) | 2009-12-16 | — | — | CN | disclosed |
| EP-2029561-A1 | TRICYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2009-03-04 | — | — | EP | disclosed |
| EP-1940401-A4 | ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS | MERCK & CO INC (US) | 2008-12-17 | — | — | EP | disclosed |
| EP-1940401-A2 | ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007148808-A1 | TRICYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-27 | — | — | WO | disclosed |
| WO-2007047496-A2 | ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2007-04-26 | — | — | WO | disclosed |
| CN-1249023-C | Ester compound and use thereof | SUMITOMO CHEMICAL CO (JP) | 2006-04-05 | — | — | CN | disclosed |
| US-6908945-B2 | Ester compound and its use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2005-06-21 | — | — | US | disclosed |
| CN-1451650-A | Ester compound and use thereof | SUMITOMO CHEMICAL CO (JP) | 2003-10-29 | — | — | CN | disclosed |
| US-20030195119-A1 | 2,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl 2-(2-cyanopropenyl)-3,3-dimethylcyclopropanecarboxylate; pesticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-10-16 | — | — | US | disclosed |