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SCHEMBL4603570

SCHEMBL4603570

Cn1nc(C(C)(C)C)cc1NC(=O)Nc1cccc(C2CCN(C(=O)c3c(Cl)cccc3Cl)CC2)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.55
▸ MAPK14 Q16539 17/20 0.53
▸ MAPK13 O15264 4/20 0.52
▸ MAPK11 Q15759 4/20 0.52
▸ MAPK12 P53778 3/20 0.52
▸ MAPT P10636 2/20 0.52
▸ RAF1 P04049 1/20 0.43
▸ ERBB2 P04626 1/20 0.43

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
SCHEMBL4603231 0.85 LMNA (0.52) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL4604383 0.83 LMNA (0.54) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL2960137 0.83 MAPK14 (0.55) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL2950992 0.81 MAPK14 (0.58) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL4602537 0.81 MAPK14 (0.60) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL4603086 0.81 NTRK1 (0.49) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL4602559 0.81 LMNA (0.49) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL2957789 0.80 LMNA (0.49) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL4603928 0.78 MAPK14 (0.51) LMNAMAPK14MAPK13MAPK11MAPK12
SCHEMBL4602968 0.77 MAPK14 (0.52) LMNAMAPK14MAPK13MAPK11MAPK12

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