SCHEMBL6869293

SCHEMBL6869293

Cc1cc(F)ccc1NC(=S)NC1CCC(Nc2nccc(N(C)C)n2)CC1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.46
ADRA2A P08913 5/20 0.43
HRH1 P35367 5/20 0.43
HTR2B P41595 4/20 0.43
ADRA1A P35348 3/20 0.43
MAPK14 Q16539 2/20 0.40

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
SCHEMBL6869286 1.00 MCHR1 (0.46) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6876830 0.90 NPC1 (0.44) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6876838 0.90 NPC1 (0.44) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6876048 0.89 MCHR1 (0.46) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6876054 0.89 MCHR1 (0.46) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6876682 0.88 MCHR1 (0.40) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6876689 0.88 MCHR1 (0.40) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6875924 0.87 MCHR1 (0.46) MCHR1
SCHEMBL6875932 0.87 MCHR1 (0.46) MCHR1
SCHEMBL6875000 0.84 ALDH1A1 (0.47) MCHR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP disclosed