SCHEMBL370197

SCHEMBL370197

Cc1ccccc1C(CC(=NO)C1=CN(C)CC=C1)c1ccc(Br)cc1F

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 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
SCHEMBL370196 0.79 GPBAR1 (0.42) GPBAR1
SCHEMBL369994 0.76 GPBAR1 (0.50) GPBAR1
SCHEMBL369995 0.76 GPBAR1 (0.50) GPBAR1
SCHEMBL371379 0.66 GPBAR1 (0.39) GPBAR1
SCHEMBL364013 0.65 GPBAR1 (0.56) GPBAR1
SCHEMBL1390173 0.65 GPBAR1 (0.56) GPBAR1
SCHEMBL1390174 0.65 GPBAR1 (0.56) GPBAR1
SCHEMBL1389828 0.65 GPBAR1 (0.53) GPBAR1
SCHEMBL363939 0.65 GPBAR1 (0.53) GPBAR1
SCHEMBL1389826 0.65 GPBAR1 (0.53) GPBAR1

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-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed