SCHEMBL5499237

SCHEMBL5499237

CON=C1CCOCCN1c1ccc(NC(=O)C2(NC(=O)Oc3ccc(Br)s3)CCOC2)cc1C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.36
FAAH O00519 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
GAA P10253 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL5509110 0.93 F10 (0.38) F10FAAHTRPV1GAA
SCHEMBL5505624 0.93 FAAH (0.40) F10FAAHTRPV1GAA
SCHEMBL5508680 0.90 F10 (0.35) F10FAAHTRPV1GAA
SCHEMBL5524020 0.90 F10 (0.35) F10FAAHTRPV1
SCHEMBL4475012 0.89 F10 (0.40) F10GAA
SCHEMBL5502455 0.89 F10 (0.42) F10FAAHTRPV1GAA
SCHEMBL5513037 0.88 F10 (0.37) F10FAAHTRPV1GAA
SCHEMBL5506302 0.88 F10 (0.37) F10FAAHTRPV1GAA
SCHEMBL5507232 0.85 FAAH (0.40) F10FAAHTRPV1
SCHEMBL5504266 0.85 FAAH (0.41) F10FAAHTRPV1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1747217-A1 NOVEL SUBSTITUTED THIOPHENECARBOXAMIDES, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2007-01-31 EP disclosed
WO-2005111029-A1 NOVEL SUBSTITUTED THIOPHENECARBOXAMIDES, THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 WO disclosed