SCHEMBL4047265

SCHEMBL4047265

O=C(Cn1ccc(OCc2ccccc2)cc1=O)c1ccc(CBr)cn1.O=C(Cn1ccc(OCc2ccccc2)cc1=O)c1ccc(CBr)cn1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 19/20 0.58
MAPK14 Q16539 1/20 0.54

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
SCHEMBL4052781 1.00 MCHR1 (0.58) MCHR1MAPK14
SCHEMBL4045120 0.91 MCHR1 (0.59) MCHR1MAPK14
SCHEMBL13748472 0.90 MCHR1 (0.58) MCHR1MAPK14
SCHEMBL1366725 0.85 MCHR1 (0.75) MCHR1MAPK14
SCHEMBL15238529 0.80 MCHR1 (0.82) MCHR1
SCHEMBL4050982 0.80 MCHR1 (0.64) MCHR1MAPK14
SCHEMBL4045555 0.78 MAPK14 (0.72) MCHR1MAPK14
SCHEMBL1364736 0.78 MCHR1 (0.73) MCHR1MAPK14
SCHEMBL1365451 0.77 MCHR1 (0.77) MCHR1MAPK14
SCHEMBL4489978 0.76 MAPK14 (0.68) MCHR1MAPK14

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