SCHEMBL4046530

SCHEMBL4046530

CN1CCCCC1c1ccc(C(=O)Cn2ccc(OCc3ccccc3)cc2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.62
KCNH2 Q12809 1/20 0.51

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
SCHEMBL4054066 0.84 MCHR1 (0.63) MCHR1KCNH2
SCHEMBL4045768 0.82 MCHR1 (0.59) MCHR1
SCHEMBL1367210 0.81 MCHR1 (0.78) MCHR1
SCHEMBL4051644 0.78 MCHR1 (0.59) MCHR1
SCHEMBL1365451 0.78 MCHR1 (0.77) MCHR1
SCHEMBL1367239 0.78 MCHR1 (0.79) MCHR1
SCHEMBL1368451 0.77 MCHR1 (0.63) MCHR1
SCHEMBL1366725 0.77 MCHR1 (0.75) MCHR1
SCHEMBL13748943 0.77 MCHR1 (0.60) MCHR1
SCHEMBL15249806 0.77 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 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