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SCHEMBL4604146

SCHEMBL4604146

Cn1nc(C(C)(C)C)cc1NC(=O)Nc1ccc(OC2CCN(C(=O)c3cccnc3Cl)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 18/20 0.52
▸ MAPK13 O15264 2/20 0.52
▸ MAPK11 Q15759 2/20 0.52
▸ MAPT P10636 1/20 0.52
▸ MAPK12 P53778 1/20 0.52
▸ RAF1 P04049 1/20 0.51
▸ BRAF P15056 1/20 0.47
▸ ERBB2 P04626 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
SCHEMBL4603670 0.90 MAPK13 (0.53) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4603358 0.90 MAPK14 (0.57) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4603357 0.86 MAPK14 (0.57) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL2960137 0.85 MAPK14 (0.55) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL2953552 0.84 MAPK14 (0.63) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4601552 0.84 MAPK14 (0.55) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4603137 0.83 MAPK14 (0.54) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4604062 0.83 EPHX2 (0.53) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4603924 0.82 MAPK14 (0.53) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL4603252 0.82 MAPK14 (0.53) MAPK14MAPK13MAPK11MAPTMAPK12

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