SCHEMBL7569754

SCHEMBL7569754

Cc1ccccc1Nc1ccc(C(=S)c2cc(Cl)sc2Cl)c(Cl)c1.Cc1ccccc1Nc1ccc(C(=S)c2ccc3[nH]ccc3c2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.42
MAPK13 O15264 8/20 0.42
MAPK12 P53778 8/20 0.42
MAPK11 Q15759 8/20 0.42
MAOA P21397 6/20 0.38
MAOB P27338 5/20 0.38
CTNNB1 P35222 1/20 0.37
WNT3A P56704 1/20 0.37
ULK1 O75385 1/20 0.37
NOTUM Q6P988 1/20 0.33
EGFR P00533 1/20 0.33
FLT1 P17948 1/20 0.33

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
SCHEMBL7082594 0.91 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11MAOA
SCHEMBL7076771 0.85 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7079600 0.80 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11MAOA
SCHEMBL7076164 0.78 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11MAOA
SCHEMBL7076162 0.78 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11MAOA
SCHEMBL7079285 0.75 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5174459 0.72 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7082071 0.71 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7082070 0.71 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7076169 0.71 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11

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