SCHEMBL7566463

SCHEMBL7566463

Cc1ccccc1Nc1ccc(C(=NO)c2ccc3[nH]ccc3c2)c(Cl)c1.Cc1ccccc1Nc1ccc(C(=NO)c2nccc(O)c2Cl)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.39
MAPK13 O15264 5/20 0.39
MAPK12 P53778 5/20 0.39
MAPK11 Q15759 5/20 0.39
ULK1 O75385 1/20 0.38
PTK6 Q13882 1/20 0.36
PRKD1 Q15139 1/20 0.36
MAOB P27338 4/20 0.35
MAOA P21397 3/20 0.35
CTNNB1 P35222 1/20 0.34
WNT3A P56704 1/20 0.34
EGFR P00533 2/20 0.34
FLT1 P17948 2/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
NOTUM Q6P988 1/20 0.33
TGFBR1 P36897 1/20 0.32

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
SCHEMBL7076162 0.88 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11ULK1
SCHEMBL7076164 0.88 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11ULK1
SCHEMBL7079600 0.76 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11ULK1
SCHEMBL7082594 0.76 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11ULK1
SCHEMBL7079509 0.74 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7079512 0.74 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7081916 0.74 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7081913 0.74 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7571963 0.74 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7566944 0.74 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11PTK6

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