SCHEMBL360940

SCHEMBL360940

C=C[CH]c1nccs1

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
SCHEMBL2403062 0.80 ALDH1A1 (0.42)
SCHEMBL39666 0.80
Water SCHEMBL1276018 0.78
Bromide SCHEMBL4252005 0.78
SCHEMBL15870899 0.74 RIOK2 (0.49)
SCHEMBL9110463 0.73
SCHEMBL4077175 0.70
SCHEMBL14629165 0.70
SCHEMBL3428422 0.70
SCHEMBL21219440 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106998685-A 14-membered ketolides and methods of making and using the same 哈佛大学的校长及成员们 2017-08-01 CN claimed
CN-105246334-A Macrolides and methods of making and using the same HARVARD COLLEGE 2016-01-13 CN claimed
CN-105218516-A Therapeutic compounds and related methods of use OTSUKA PHARMA CO LTD 2016-01-06 CN claimed
CN-102883723-A Therapeutic compounds and related methods of use GALENEA CORP 2013-01-16 CN claimed
US-8067419-B2 N-[(S)-1-benzyl-2-(4-benzyl-piperazin-1-yl)-2-oxo-ethyl]-N-(4-pentyl-benzyl)-3-(4-trifluoromethyl-phenyl)-acrylamide, for example; antiprotozoa agents ACTELION PHARMACEUTICALS LTD. (CH) 2011-11-29 US claimed
CN-100549011-C Novel imidazopyridine as cell cycle protein dependent kinase inhibitor SCHERING CORP (US) 2009-10-14 CN claimed
CN-101300241-A Piperazine derivatives as antimalarial agents ACTELION PHARMACEUTICALS LTD (CH) 2008-11-05 CN claimed
US-20080234272-A1 Novel Piperazines as Antimalarial Agents ACTELION PHARMACEUTICALS LTD. (CH) 2008-09-25 US claimed
EP-1940814-A1 PIPERAZINE DERIVATIVES AS ANTIMALARIAL AGENTS Actelion Pharmaceuticals Ltd. (CH) 2008-07-09 EP claimed
WO-2007046075-A1 PIPERAZINE DERIVATIVES AS ANTIMALARIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2007-04-26 WO claimed
CN-1373662-A 3(5)-amino-pyrazole derivs., process for their preparation and their use as antitumor agents PHARMACIA & UP JOHN S P A (IT) 2002-10-09 CN claimed
CN-1342157-A Substituted pyrazoles ASP38 kinase inhibitors SEARLE & CO (US) 2002-03-27 CN claimed
CN-1310716-A Tricyclic sulfonamides and their derivatives as inhibitors of matrix metalloproteinases WARNER LAMBERT CO (US) 2001-08-29 CN claimed
CN-1227548-A Substituted p-trifluoromethylphenyluracils BAYER AG (DE) 1999-09-01 CN claimed
CN-1216538-A Substituted 2-aryl-1,2,4-triazine-3,5-di(thi) ones as herbicides BAYER AG (DE) 1999-05-12 CN claimed
CN-1175249-A 3-aryl-1, 2, 4-triazole derivatives having herbicidal properties BAYER AG (DE) 1998-03-04 CN claimed
EP-0544819-B1 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS ABBOTT LAB (US) 1995-12-06 EP claimed
EP-0544819-A4 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS 1993-10-20 EP claimed
EP-0544819-A1 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS. ABBOTT LAB (US) 1993-06-09 EP claimed
WO-1992003132-A1 INDOLE DERIVATIVES WHICH INHIBIT LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1992-03-05 WO claimed