SCHEMBL7566944

SCHEMBL7566944

Cc1ccccc1Nc1ccc(C(=S)c2nccc(O)c2Cl)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.52
MAPK13 O15264 10/20 0.52
MAPK12 P53778 10/20 0.52
MAPK11 Q15759 10/20 0.52
PTK6 Q13882 1/20 0.38
AURKA O14965 1/20 0.37
CCNK O75909 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CDK9 P50750 1/20 0.37
MAPK10 P53779 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
P2RX7 Q99572 1/20 0.35
S1PR1 P21453 1/20 0.35
RIPK2 O43353 1/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL7571963 0.87 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7079282 0.85 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7082606 0.85 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7566947 0.82 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7076132 0.80 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11MEN1
SCHEMBL5174459 0.79 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL7075155 0.78 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL7080485 0.77 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11PTK6
SCHEMBL1897537 0.76 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11MEN1
SCHEMBL7079813 0.75 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11MEN1

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