SCHEMBL6878737

SCHEMBL6878737

CCOc1ccc(Br)cc1CNCC1CCC(Nc2nccc(N(C)C)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.49
ADRA2A P08913 7/20 0.49
NPY5R Q15761 5/20 0.49
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CCR5 P51681 2/20 0.35
LMNA P02545 3/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
HTR2B P41595 1/20 0.34

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
SCHEMBL6456397 1.00 MCHR1 (0.49) MCHR1ADRA2ANPY5RALDH1A1MEN1
SCHEMBL6464914 0.92 MCHR1 (0.49) MCHR1ADRA2ANPY5RALDH1A1MEN1
SCHEMBL6880166 0.92 MCHR1 (0.49) MCHR1ADRA2ANPY5RALDH1A1MEN1
SCHEMBL6868902 0.90 MCHR1 (0.41) MCHR1ADRA2ANPY5RADRA1AHRH1
SCHEMBL6461592 0.90 MCHR1 (0.41) MCHR1ADRA2ANPY5RADRA1AHRH1
SCHEMBL6876619 0.89 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHRH1
SCHEMBL6876624 0.89 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHRH1
SCHEMBL6462999 0.87 MCHR1 (0.46) MCHR1ADRA2ANPY5RALDH1A1MEN1
SCHEMBL6875398 0.87 MCHR1 (0.46) MCHR1ADRA2ANPY5RALDH1A1MEN1
SCHEMBL6878378 0.87 MCHR1 (0.43) MCHR1ADRA2ANPY5RADRA1AHRH1

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