SCHEMBL5532364

SCHEMBL5532364

N#CN=C1CCOCCN1c1ccc(NC(=O)C2(NC(=O)Oc3ccc(Cl)s3)CCOC2)cc1Br

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.31
ACP1 P24666 2/20 0.31
TRPV1 Q8NER1 2/20 0.31
FAAH O00519 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL5536648 0.93 F10 (0.38) F10TRPV1FAAHMEN1NPC1
SCHEMBL5510376 0.89 F10 (0.38) F10TRPV1FAAHMEN1NPC1
SCHEMBL4558647 0.89 F10 (0.38) F10MEN1ALDH1A1MAPTHTT
SCHEMBL5508680 0.86 F10 (0.35) F10TRPV1FAAH
SCHEMBL5513576 0.84 F10 (0.37) F10TRPV1FAAHMEN1NPC1
SCHEMBL4458588 0.82 F10 (0.41) F10
SCHEMBL5527807 0.82 TRPV1 (0.41) F10TRPV1FAAHMEN1NPC1
SCHEMBL5526021 0.82 TRPV1 (0.39) F10TRPV1FAAHMEN1NPC1
SCHEMBL4558759 0.81 F10 (0.44) F10MEN1NPC1ALDH1A1LMNA
SCHEMBL5530339 0.81 F10 (0.39) F10TRPV1FAAH

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