SCHEMBL7266374

SCHEMBL7266374

CNCc1ccc(-c2ccccc2S(=O)(=O)NC(C)(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.54
OPRK1 P41145 2/20 0.54
ALOX5AP P20292 15/20 0.53
FEN1 P39748 15/20 0.53
MMP3 P08254 1/20 0.46
KCNH2 Q12809 1/20 0.44

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
SCHEMBL7190899 0.85 ALOX5AP (0.55) OPRM1OPRK1ALOX5APFEN1MMP3
SCHEMBL6630002 0.84 ALOX5AP (0.57) OPRM1OPRK1ALOX5APFEN1
SCHEMBL2280981 0.84 ALOX5AP (0.54) OPRM1OPRK1ALOX5APFEN1
SCHEMBL9426493 0.83 OPRM1 (0.55) OPRM1OPRK1ALOX5APFEN1MMP3
SCHEMBL7266847 0.82 ALOX5AP (0.55) OPRM1OPRK1ALOX5APFEN1MMP3
SCHEMBL6771873 0.82 EDNRA (0.58) OPRM1OPRK1ALOX5APFEN1KCNH2
SCHEMBL1968159 0.81 ALOX5AP (0.59) ALOX5APFEN1
SCHEMBL9426237 0.81 HRH4 (0.54) OPRM1OPRK1ALOX5APFEN1MMP3
SCHEMBL7261137 0.81 SCN9A (0.55) OPRM1OPRK1
SCHEMBL6628076 0.80 ALOX5AP (0.59) ALOX5APFEN1

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-2003101381-A2 1,2 DIAMIDO CYCLOALKYL SODIUM CHANNEL BLOCKERS MERCK & CO., INC. (US) 2003-12-11 WO disclosed