SCHEMBL43052

SCHEMBL43052

[CH2]/C(=C/C)C(=O)OCC

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL8013677 1.00
SCHEMBL43053 1.00
SCHEMBL28467655 0.81 NPSR1 (0.43)
SCHEMBL7586059 0.81 NPSR1 (0.43)
SCHEMBL9375697 0.81 HCAR2 (0.42)
SCHEMBL7586064 0.81 NPSR1 (0.43)
SCHEMBL9375694 0.81 HCAR2 (0.42)
SCHEMBL6735388 0.76
SCHEMBL9375881 0.76
Ethylene SCHEMBL11047661 0.75 ALDH1A1 (0.56)

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 563 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131032-A1 NEUROTHERAPEUTIC TREATMENT FOR SEXUAL DYSFUNCTION REVAAX PHARMACEUTICALS, LLC (US) 2013-05-23 US claimed
US-7355040-B2 Process for the preparation of cephalosporin compounds and synthetic intermediates ZOETIS SERVICES LLC 2008-04-08 US claimed
US-7045619-B2 2-(pyrazol-3-yl)carbapenem derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2006-05-16 US claimed
US-20030166923-A1 2-(pyrazol-3-yl)carbapenem derivatives SMITHKLINE BEECHAM P.L.C. 2003-09-04 US claimed
US-20020147333-A1 2-(pyrazol-3-yl)carbapenem derivatives SMITHKLINE BEECHAM P.L.C. 2002-10-10 US claimed
US-6020329-A Cephaloporins and homologues, preparations and pharmaceutical compositions PZIFER INC. (US) 2000-02-01 US claimed
EP-0823911-A1 ESTERS OF CARBAPENEMS SMITHKLINE BEECHAM PLC (GB) 1998-02-18 EP claimed
WO-1996034869-A1 ESTERS OF CARBAPENEMS SMITHKLINE BEECHAM PLC (GB) 1996-11-07 WO claimed
EP-0625984-A1 CEPHALOSPORIN COMPOUNDS PFIZER INC. (US) 1994-11-30 EP claimed
WO-1993011131-A1 CEPHALOSPORIN COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 1993-06-10 WO claimed
EP-0540609-A1 CEPHALOSPORINS AND HOMOLOGUES, PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS PFIZER INC. (US) 1993-05-12 EP claimed
WO-1992001696-A1 CEPHALOSPORINS AND HOMOLOGUES, PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1992-02-06 WO claimed
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US disclosed
WO-2024064209-A1 COMPOSITIONS AND METHODS FOR TREATING MYCOBACTERIUM INFECTIONS DATA2DISCOVERY, INC. (US) 2024-03-28 WO disclosed
US-20230123729-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AZEVAN PHARMACEUTICALS INC (US) 2023-04-20 US disclosed
US-11628160-B2 Compositions and methods for treating brain injury AZEVAN PHARMACEUTICALS, INC. (US) 2023-04-18 US disclosed
WO-1992001695-A1 CEPHALOSPORINS AND HOMOLOGUES, PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1992-02-06 WO disclosed
WO-1992001696-A1 CEPHALOSPORINS AND HOMOLOGUES, PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1992-02-06 WO disclosed
US-4997472-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1991-03-05 US disclosed
EP-0379099-A1 Tetrahydroindazoles with a phenyl ether structure BASF Aktiengesellschaft (DE) 1990-07-25 EP disclosed