SCHEMBL4047720

SCHEMBL4047720

O=C(Cn1ncc(OCc2ccc(F)cc2)cc1=O)c1ccc2c(c1)CNCC2

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.51
MELK Q14680 1/20 0.42

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
SCHEMBL1365684 0.91 MCHR1 (0.60) MCHR1
SCHEMBL4043169 0.84 MCHR1 (0.50) MCHR1MELK
SCHEMBL1366831 0.83 MCHR1 (0.64) MCHR1
SCHEMBL1367344 0.83 MCHR1 (0.61) MCHR1
SCHEMBL4046311 0.83 MCHR1 (0.61) MCHR1
SCHEMBL4043875 0.82 MCHR1 (0.51) MCHR1
SCHEMBL13749108 0.81 MCHR1 (0.50) MCHR1
SCHEMBL4538551 0.81 MCHR1 (0.49) MCHR1
SCHEMBL4052786 0.81 MCHR1 (0.51) MCHR1
SCHEMBL4045339 0.80 MCHR1 (0.49) 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