SCHEMBL4732285

SCHEMBL4732285

O=C(O)NC[C@@H]1CCN(c2ccc(-n3ccc(O)cc3=O)cn2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.51
SCD O00767 2/20 0.44
DPP4 P27487 3/20 0.44
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPT P10636 3/20 0.38
MCL1 Q07820 2/20 0.38
ALOX15 P16050 2/20 0.38
MAPK1 P28482 2/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GFER P55789 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL4732124 0.85 MCHR1 (0.73) MCHR1SCDDPP4CYP3A4KCNH2
SCHEMBL4888561 0.85 MCHR1 (0.73) MCHR1SCDDPP4CYP3A4KCNH2
SCHEMBL4731538 0.81 MCHR1 (0.53) MCHR1DPP4MAPTCYP3A4KCNH2
SCHEMBL4887824 0.80 MCHR1 (0.47) MCHR1SCDDPP4ALDH1A1KDM4E
SCHEMBL4796070 0.80 MCHR1 (0.65) MCHR1SCDDPP4CYP3A4KCNH2
SCHEMBL14223178 0.79 MCHR1 (0.54) MCHR1KCNH2
SCHEMBL4732287 0.78 MCHR1 (0.51) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL4887821 0.78 MCHR1 (0.45) MCHR1SCDDPP4KCNH2DPP8
SCHEMBL1750254 0.77 ALDH1A1 (0.41) MCHR1ALDH1A1KDM4EMAPTMCL1
SCHEMBL1749645 0.77 ALDH1A1 (0.41) MCHR1ALDH1A1KDM4EMAPTMCL1

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
WO-2008041090-A1 MALANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONIST PYRIDINONES PFIZER LIMITED (GB) 2008-04-10 WO disclosed