SCHEMBL14627110

SCHEMBL14627110

Cc1ccc(C(=O)NN2C=CCC2)cc1Nc1ncnn2cc(C(=O)O)c(C)c12

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 20/20 0.61
▸ MAPK11 Q15759 2/20 0.59

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
SCHEMBL12729611 0.84 MAPK14 (0.67) MAPK14MAPK11
SCHEMBL12729587 0.83 MAPK14 (0.68) MAPK14MAPK11
SCHEMBL14627175 0.82 MAPK14 (0.62) MAPK14MAPK11
SCHEMBL4319737 0.81 MAPK14 (0.85) MAPK14MAPK11
SCHEMBL12728839 0.78 MAPK14 (0.68) MAPK14MAPK11
SCHEMBL13755665 0.78 MAPK14 (0.87) MAPK14MAPK11
SCHEMBL12728972 0.77 MAPK14 (0.89) MAPK14MAPK11
SCHEMBL12729681 0.76 MAPK14 (1.00) MAPK14MAPK11
SCHEMBL12729703 0.76 MAPK14 (0.91) MAPK14MAPK11
SCHEMBL12728825 0.76 MAPK14 (0.85) MAPK14MAPK11

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
US-7160883-B2 Pyrrolo-triazine aniline compounds useful as kinase inhibitors BRISTOL-MYERS-SQUIBB COMPANY (US) 2007-01-09 — — US disclosed
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