SCHEMBL6875455

SCHEMBL6875455

CN(C)c1ccnc(N[C@H]2CC[C@@H](CNC(=O)c3cccc(Cl)c3Cl)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 9/20 0.51
P2RX7 Q99572 9/20 0.44
ADRA2A P08913 3/20 0.43
HTR2B P41595 3/20 0.43
ADRA1A P35348 2/20 0.43
HRH1 P35367 2/20 0.43
CHRM1 P11229 1/20 0.42
HTR1A P08908 1/20 0.42
CNR2 P34972 1/20 0.41

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
SCHEMBL6875462 1.00 MCHR1 (0.51) MCHR1P2RX7ADRA2AHTR2BADRA1A
SCHEMBL6876588 0.92 MCHR1 (0.50) MCHR1P2RX7ADRA2AHTR2BADRA1A
SCHEMBL6876594 0.92 MCHR1 (0.50) MCHR1P2RX7ADRA2AHTR2BADRA1A
SCHEMBL6867713 0.90 MCHR1 (0.53) MCHR1P2RX7ADRA2AHTR2BADRA1A
SCHEMBL6867719 0.90 MCHR1 (0.53) MCHR1P2RX7ADRA2AHTR2BADRA1A
SCHEMBL6880528 0.87 MCHR1 (0.48) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6880535 0.87 MCHR1 (0.48) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6878345 0.86 MCHR1 (0.49) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6878353 0.86 MCHR1 (0.49) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6875684 0.86 MCHR1 (0.51) MCHR1ADRA2AHTR2BADRA1AHRH1

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