SCHEMBL5544563

SCHEMBL5544563

CCc1cc(-n2nc(C(F)(F)F)cc2NC(=O)Nc2ccc(Cl)cc2)ccc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.58
MAPK13 O15264 8/20 0.58
MAPK12 P53778 8/20 0.58
MAPK11 Q15759 8/20 0.58
DDR2 Q16832 3/20 0.56
MAPK9 P45984 1/20 0.56
KCNJ6 P48051 1/20 0.55
KCNJ5 P48544 1/20 0.55
KCNJ3 P48549 1/20 0.55
BACE1 P56817 1/20 0.54
SRC P12931 1/20 0.54
ORAI1 Q96D31 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL2080380 0.81 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL2080486 0.80 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL4047547 0.78 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL4055465 0.77 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL3300823 0.75 MAPK14 (0.80) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL4055743 0.75 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL3293561 0.74 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL27640941 0.74 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL12245421 0.74 MAPK14 (0.88) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL2079824 0.73 MAPK14 (0.81) MAPK14MAPK13MAPK12MAPK11DDR2

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
EP-1835934-A2 ENZYME MODULATORS AND TREATMENTS Deciphera Pharmaceuticals, LLC (US) 2007-09-26 EP disclosed
WO-2006071940-A2 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-07-06 WO disclosed