SCHEMBL6878378

SCHEMBL6878378

CCOc1c(Br)cc(Br)cc1CNCC1CCC(Nc2nccc(N(C)C)n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.43
ADRA2A P08913 7/20 0.43
NPY5R Q15761 3/20 0.43
ADRA1A P35348 3/20 0.33
HTR2B P41595 3/20 0.33
HRH1 P35367 2/20 0.33
ACHE P22303 2/20 0.33
MAPK14 Q16539 1/20 0.32
HTR1A P08908 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL6467603 1.00 MCHR1 (0.43) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6880752 0.92 MCHR1 (0.43) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6457840 0.92 MCHR1 (0.43) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6878737 0.87 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6456397 0.87 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6876624 0.83 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6876619 0.83 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6460406 0.82 MCHR1 (0.46) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6460395 0.82 MCHR1 (0.46) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6880166 0.82 MCHR1 (0.49) MCHR1ADRA2ANPY5RACHEBACE1

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