SCHEMBL4050982

SCHEMBL4050982

O=C(Cn1ccc(OCc2ccccc2)cc1=O)c1ccc(CBr)cc1F

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 19/20 0.64
MAPK14 Q16539 1/20 0.53

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
SCHEMBL13748127 0.90 MCHR1 (0.61) MCHR1MAPK14
SCHEMBL15238529 0.88 MCHR1 (0.82) MCHR1
SCHEMBL1366725 0.84 MCHR1 (0.75) MCHR1MAPK14
SCHEMBL1365438 0.81 MCHR1 (0.62) MCHR1MAPK14
SCHEMBL4051282 0.81 MCHR1 (0.62) MCHR1MAPK14
SCHEMBL4052781 0.80 MCHR1 (0.58) MCHR1MAPK14
SCHEMBL4047265 0.80 MCHR1 (0.58) MCHR1MAPK14
SCHEMBL27751488 0.79 MCHR1 (0.62) MCHR1MAPK14
SCHEMBL15238702 0.78 MCHR1 (0.80) MCHR1
SCHEMBL15238509 0.78 MCHR1 (1.00) MCHR1

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-2009103478-A1 PYRIDONE AND PYRIDAZINONE DERIVATIVES AS MCH ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-08-27 WO disclosed