SCHEMBL7565453

SCHEMBL7565453

Cc1cc[nH]c1C(=O)c1ccc(Nc2ccccc2N)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.70
MAPK13 O15264 17/20 0.70
MAPK12 P53778 17/20 0.70
MAPK11 Q15759 17/20 0.70
GRM1 Q13255 1/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL7566205 0.90 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11GRM1
SCHEMBL7570546 0.83 MAPK14 (0.72) MAPK14MAPK13MAPK12MAPK11GRM1
SCHEMBL2201099 0.82 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL6652753 0.81 MAPK14 (0.80) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL7565415 0.79 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL6652082 0.79 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6654823 0.78 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL5989531 0.78 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL7076307 0.78 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11GRM1
SCHEMBL2198320 0.78 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11GAA

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