SCHEMBL3392836

SCHEMBL3392836

Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OC3CCN(C(=O)c4ccccc4F)CC3)nc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 8/20 0.53
MAPK14 Q16539 7/20 0.53
MAPK12 P53778 6/20 0.53
MAPK11 Q15759 6/20 0.53
PTK2 Q05397 10/20 0.48
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C8 P10632 1/20 0.47
MAPK9 P45984 1/20 0.47

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
SCHEMBL3391089 0.93 MAPK14 (0.52) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3392453 0.92 MAPK14 (0.53) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL13528639 0.88 MAPK14 (0.51) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL2951258 0.88 MAPK14 (0.54) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3394275 0.86 MAPK14 (0.49) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3388913 0.85 MAPK14 (0.55) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3390223 0.84 MAPK14 (0.52) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3178035 0.84 MAPK14 (0.46) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3423893 0.82 MAPK14 (0.62) MAPK13MAPK14MAPK12MAPK11PTK2
SCHEMBL3390254 0.82 MAPK14 (0.49) MAPK13MAPK14MAPK12MAPK11PTK2

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
EP-1943243-B1 KINASE INHIBITORS LILLY CO ELI (US) 2010-12-29 EP disclosed