SCHEMBL6877932

SCHEMBL6877932

CN(C)c1nc(NC2CCC(CNC(=O)c3ccccc3Br)CC2)nc2c1CCCC2

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.51
ADRA2A P08913 9/20 0.51
NPY5R Q15761 4/20 0.51
ADRA1A P35348 2/20 0.46
HTR2B P41595 2/20 0.46
HRH1 P35367 1/20 0.46
HTR1A P08908 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL6877928 1.00 MCHR1 (0.51) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6878748 0.91 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6878754 0.91 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL27631579 0.89 MCHR1 (0.50) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6875675 0.89 MCHR1 (0.47) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6875673 0.89 MCHR1 (0.47) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6874253 0.88 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6874247 0.88 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6875435 0.86 MCHR1 (0.47) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6873446 0.86 MCHR1 (0.50) MCHR1ADRA2ANPY5RADRA1AHTR2B

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