SCHEMBL4002396

SCHEMBL4002396

CN(Cc1ccc(CCn2ccc(OCc3ccccc3)cc2=O)cc1)C(=O)O

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 19/20 0.82
MAPK14 Q16539 1/20 0.56
KCNH2 Q12809 2/20 0.52

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
SCHEMBL1365787 0.89 MCHR1 (0.71) MCHR1MAPK14KCNH2
SCHEMBL1365313 0.84 MCHR1 (0.73) MCHR1MAPK14KCNH2
SCHEMBL1364736 0.82 MCHR1 (0.73) MCHR1MAPK14KCNH2
SCHEMBL1364955 0.81 MCHR1 (0.72) MCHR1MAPK14KCNH2
SCHEMBL15249806 0.80 MCHR1 (1.00) MCHR1
SCHEMBL4045683 0.79 MAPK14 (0.74) MCHR1MAPK14KCNH2
SCHEMBL1364816 0.77 MCHR1 (0.82) MCHR1MAPK14KCNH2
SCHEMBL12162794 0.77 MCHR1 (0.66) MCHR1MAPK14KCNH2
SCHEMBL2881955 0.77 MCHR1 (1.00) MCHR1KCNH2
SCHEMBL2881740 0.77 MCHR1 (0.81) MCHR1MAPK14KCNH2

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
EP-2069327-A1 NEW PYRIDONE DERIVATIVES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS Boehringer Ingelheim International GmbH (DE) 2009-06-17 EP disclosed
WO-2008022979-A1 NEW PYRIDONE DERIVATIVES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-02-28 WO disclosed