SCHEMBL4047049

SCHEMBL4047049

CN1CCc2cc(CCn3ccc(OCc4ccc(F)cn4)cc3=O)ccc2C1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.52
KCNH2 Q12809 2/20 0.50

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
SCHEMBL13748817 0.97 MCHR1 (0.53) MCHR1KCNH2
SCHEMBL13748449 0.93 MCHR1 (0.55) MCHR1KCNH2
SCHEMBL4052318 0.90 MCHR1 (0.56) MCHR1
SCHEMBL1365770 0.90 MCHR1 (0.56) MCHR1
SCHEMBL13748467 0.88 MCHR1 (0.53) MCHR1KCNH2
SCHEMBL1367546 0.88 MCHR1 (0.52) MCHR1KCNH2
SCHEMBL1367195 0.87 MCHR1 (0.57) MCHR1
SCHEMBL4048588 0.87 MCHR1 (0.57) MCHR1
SCHEMBL1367829 0.86 MCHR1 (0.58) MCHR1
SCHEMBL4216316 0.86 MCHR1 (0.51) MCHR1KCNH2

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