⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4849528 | 0.83 | — | — | |
| SCHEMBL8108910 | 0.82 | — | — | |
| SCHEMBL11691914 | 0.80 | — | — | |
| SCHEMBL27775693 | 0.78 | LMNA (0.41) | — | |
| SCHEMBL4257430 | 0.78 | TSHR (0.30) | — | |
| Benzene SCHEMBL28119462 | 0.76 | CA2 (0.33) | — | |
| SCHEMBL11114369 | 0.75 | — | — | |
| SCHEMBL1558889 | 0.73 | — | — | |
| SCHEMBL27721707 | 0.73 | — | — | |
| SCHEMBL20033603 | 0.73 | PRKD3 (0.37) | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115960291-A | Preparation method of long-chain haloalkyl styrene polymer | 南京大学 | 2023-04-14 | — | — | CN | claimed |
| CN-100430358-C | Process for synthesizing 4-chlorobutyl methyl ether | UNIV HEBEI POLYTECHNIC (CN) | 2008-11-05 | — | — | CN | claimed |
| WO-2007117482-A2 | RENIN INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2007-10-18 | — | — | WO | claimed |
| CN-1944366-A | Process for synthesizing 4-chlorobutyl methyl ether | UNIV HEBEI POLYTECHNIC (CN) | 2007-04-11 | — | — | CN | claimed |
| CN-115960291-A | Preparation method of long-chain haloalkyl styrene polymer | 南京大学 | 2023-04-14 | — | — | CN | disclosed |
| CN-108191630-A | 1- is to the synthetic method of fluoroform phenyl -5- methoxyl groups-pentanone | 千辉药业（安徽）有限责任公司 | 2018-06-22 | — | — | CN | disclosed |
| CN-104254537-B | Phragmalin limonoids for the treatment of sexual dysfunction | 戴考缇立登公司 | 2017-06-30 | — | — | CN | disclosed |
| CN-104254537-A | Phragmalin limonoids for the treatment of sexual dysfunction | DICOTYLEDON AB | 2014-12-31 | — | — | CN | disclosed |
| CN-102641748-B | Preparation method of hydroxyl burning-rate catalyst for substituent ferrocenylsilanes grafting and product thereof | UNIV CHINA GEOSCIENCES WUHAN | 2014-04-30 | — | — | CN | disclosed |
| CN-102686632-A | Process for manufacturing a product derived from epichlorohydrin | SOLVAY | 2012-09-19 | — | — | CN | disclosed |
| CN-102641748-A | Preparation method of hydroxyl burning-rate catalyst for substituent ferrocenylsilanes grafting and product thereof | UNIV CHINA GEOSCIENCES WUHAN | 2012-08-22 | — | — | CN | disclosed |
| US-8158652-B2 | 1-Difluoromethyl-5-{4-[3-(1-piperidinyl)propoxy]phenyl}-2(1H)-pyridone; compounds act as histamine-H3 receptor antagonistic substances or inverse-agonistic substances; useful as preventives or remedies for various circular system diseases, nervous system diseases, metabolic system diseases | MSD K.K. (JP) | 2012-04-17 | — | — | US | disclosed |
| EP-0542411-A2 | Tetrahydrothienopyridine derivatives, furo and pyrrolo analogs thereof and their preparation and uses for inhibiting blood platelet aggregation | Sankyo Company Limited (JP) | 1993-05-19 | — | — | EP | disclosed |
| EP-0214793-B1 | (2-CYANO-2-ARYLETHYL)PYRIDINES, THEIR PREPARATION AND USE AS FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1990-06-13 | — | — | EP | disclosed |
| US-4933339-A | PHYTOPATHOGENS | ROHM AND HAAS COMPANY (US) | 1990-06-12 | — | — | US | disclosed |
| EP-0284237-A1 | Production of substituted acetylenic compounds | Takeda Chemical Industries, Ltd. (JP) | 1988-09-28 | — | — | EP | disclosed |
| EP-0219654-A2 | Process for the preparation of 4-chlorbutanals | Degussa Aktiengesellschaft (DE) | 1987-04-29 | — | — | EP | disclosed |
| US-4080461-A | PESTICIDES, FUNGICIDES | SYNTEX (U.S.A.) INC. (US) | 1978-03-21 | — | — | US | disclosed |
| US-4038386-A | INOTROPIC AGENTS | DEUTSCH GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1977-07-26 | — | — | US | disclosed |
| US-4002640-A | ANTIFUNGAL AGENTS | SYNTEX (U.S.A.) INC. (US) | 1977-01-11 | — | — | US | disclosed |