SCHEMBL13748844

SCHEMBL13748844

C=C(Cn1ccc(OCc2ccccc2)cc1=O)c1ccc(CN2CCC(C)(OC)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 16/20 0.57
MAPK14 Q16539 1/20 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
SCHEMBL15310276 0.91 MCHR1 (0.65) MCHR1MAPK14
SCHEMBL4045053 0.90 MCHR1 (0.64) MCHR1MAPK14
SCHEMBL1364943 0.87 MCHR1 (0.68) MCHR1MAPK14
SCHEMBL15310239 0.81 MCHR1 (0.73) MCHR1MAPK14
SCHEMBL1365010 0.81 MCHR1 (0.59) MCHR1MAPK14
SCHEMBL13748588 0.78 MCHR1 (0.59) MCHR1MAPK14
SCHEMBL15310293 0.78 MCHR1 (0.64) MCHR1MAPK14
SCHEMBL1367210 0.77 MCHR1 (0.78) MCHR1MAPK14
SCHEMBL1365390 0.76 MAPK14 (0.56) MCHR1MAPK14
SCHEMBL15310200 0.76 MCHR1 (0.62) 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