SCHEMBL6876330

SCHEMBL6876330

Cc1ccccc1NC(=O)NCC1CCC(Nc2nccc(N(C)C)n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.45
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ADRA2A P08913 2/20 0.44
ADRA1A P35348 2/20 0.44
HTR2B P41595 2/20 0.44
HRH1 P35367 1/20 0.44
HTR1A P08908 1/20 0.42
MAPK14 Q16539 4/20 0.40
MAPK8 P45983 1/20 0.39
ITGB3 P05106 2/20 0.39
ITGAV P06756 2/20 0.39
ITGB1 P05556 1/20 0.39
ITGA5 P08648 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL6876325 1.00 MCHR1 (0.45) MCHR1MAPTL3MBTL1ADRA2AADRA1A
SCHEMBL6873985 0.90 MCHR1 (0.43) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6873991 0.90 MCHR1 (0.43) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6875360 0.90 MCHR1 (0.43) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6875353 0.90 MCHR1 (0.43) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6875689 0.90 MAPK14 (0.50) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6875685 0.90 MAPK14 (0.50) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6462879 0.90 MCHR1 (0.46) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6462870 0.90 MCHR1 (0.46) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6460789 0.89 MCHR1 (0.42) MCHR1ADRA2AADRA1AHTR2BHRH1

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