SCHEMBL6880776

SCHEMBL6880776

Cc1ccc(C(=O)NC2CCC(Nc3cc(N(C)C)c4ccccc4n3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.56
ADRA2A P08913 13/20 0.56
HRH1 P35367 3/20 0.53
HTR2B P41595 3/20 0.53
ADRA1A P35348 2/20 0.53
HTR1A P08908 1/20 0.53
NPY5R Q15761 1/20 0.53
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL6880770 1.00 MCHR1 (0.56) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6879865 0.94 MCHR1 (0.57) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6879862 0.94 MCHR1 (0.57) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6878593 0.91 MCHR1 (0.50) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6878596 0.91 MCHR1 (0.50) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6461979 0.91 MCHR1 (0.68) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6868248 0.91 MCHR1 (0.55) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6455836 0.91 MCHR1 (0.57) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6461973 0.91 MCHR1 (0.68) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6868255 0.91 MCHR1 (0.55) MCHR1ADRA2AHRH1HTR2BADRA1A

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