SCHEMBL7567075

SCHEMBL7567075

CNC(=O)c1ccc(Nc2ccccc2C)cc1Cl

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.71
MAPK13 O15264 12/20 0.71
MAPK12 P53778 12/20 0.71
MAPK11 Q15759 12/20 0.71
GPR27 Q9NS67 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
AVPR2 P30518 1/20 0.46
OXTR P30559 1/20 0.46
AVPR1A P37288 1/20 0.46
DHODH Q02127 1/20 0.45
CHRNA7 P36544 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL27494244 0.86 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11GPR27
SCHEMBL27509293 0.86 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11MEN1
SCHEMBL1904637 0.83 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL7082048 0.80 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11GPR27
SCHEMBL7079657 0.78 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11GPR27
SCHEMBL7079244 0.78 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11MEN1
SCHEMBL27664709 0.78 ADORA2A (0.60) MAPK14MAPK13MAPK12MAPK11GPR27
SCHEMBL5174459 0.78 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11GPR27
SCHEMBL7080451 0.77 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11GPR27
SCHEMBL7074710 0.77 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11GPR27

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