SCHEMBL7567646

SCHEMBL7567646

Cc1ccc2c(C(=NO)c3ccc(Nc4ccccc4C)cc3Cl)sc(C)c2c1.Cc1ccccc1Nc1ccc(C(=NO)c2csc3ccccc23)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.41
MAPK13 O15264 9/20 0.41
MAPK12 P53778 9/20 0.41
MAPK11 Q15759 9/20 0.41
F10 P00742 4/20 0.35
PIK3CA P42336 3/20 0.34
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
RECQL P46063 1/20 0.31
MAOB P27338 1/20 0.31
CHRNA7 P36544 1/20 0.31

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
SCHEMBL7079590 0.91 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7079596 0.91 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7079458 0.88 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11PIK3CA
SCHEMBL7083133 0.85 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7083138 0.85 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7074446 0.83 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7074444 0.83 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7079594 0.79 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7082408 0.78 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11F10
SCHEMBL7083135 0.78 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11F10

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-2002083622-A2 NOVEL AMINOPHENYL KETONE DERIVATIVES LEO PHARMA A/S (DK) 2002-10-24 WO disclosed