SCHEMBL4602180

SCHEMBL4602180

Cn1nc(C(C)(C)C)cc1NC(=O)Nc1ccc(CN2CCN(C(=O)c3c(F)cccc3Cl)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.53
MAPK11 Q15759 2/20 0.53
MAPT P10636 2/20 0.53
MAPK13 O15264 1/20 0.53
MAPK12 P53778 1/20 0.53
LMNA P02545 2/20 0.52
ERBB2 P04626 1/20 0.51

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
SCHEMBL6143107 0.95 MAPK14 (0.55) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL2950992 0.94 MAPK14 (0.58) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL4604383 0.87 LMNA (0.54) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL4602560 0.87 RAB9A (0.47) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL4602710 0.86 MAPK14 (0.57) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL4602299 0.85 MAPK14 (0.47) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL2948049 0.85 MAPK14 (0.49) MAPK14MAPK11MAPTMAPK13MAPK12
SCHEMBL4603906 0.85 MAPK14 (0.55) MAPK14MAPK11MAPK13MAPK12LMNA
SCHEMBL4602913 0.84 MAPK14 (0.60) MAPK14MAPK11MAPK13MAPK12
SCHEMBL4604376 0.84 PRKAA2 (0.56) MAPK14MAPK11MAPTMAPK13MAPK12

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-1761520-B1 KINASE INHIBITORS LILLY CO ELI (US) 2008-07-09 EP disclosed