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SCHEMBL4604168

SCHEMBL4604168

COC(C)C(=O)N1CCN(c2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 4/20 0.67
▸ MAPK13 O15264 4/20 0.61
▸ MAPK12 P53778 3/20 0.61
▸ MAPK11 Q15759 3/20 0.61
▸ PTK2 Q05397 14/20 0.59
▸ CYP2D6 P10635 2/20 0.59
▸ CYP2C9 P11712 2/20 0.59
▸ MAPK9 P45984 1/20 0.57
▸ CYP2C8 P10632 1/20 0.57

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
SCHEMBL4604161 1.00 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL4602075 0.91 MAPK14 (0.72) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL4602870 0.88 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL2951206 0.85 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL2953791 0.85 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL2953763 0.85 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL4604560 0.83 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL2947692 0.83 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL4602877 0.82 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11PTK2
SCHEMBL4604814 0.82 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11PTK2

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