SCHEMBL7974385

SCHEMBL7974385

Fc1ccc(-c2c(-c3ccncc3)[nH]c3c(CCN4CCOCC4)ccnc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.52
MAPK13 O15264 4/20 0.48
MAPK12 P53778 4/20 0.48
MAPK11 Q15759 4/20 0.48
ALOX5 P09917 1/20 0.46
EGFR P00533 1/20 0.41
MET P08581 1/20 0.40

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
SCHEMBL4585066 0.73 ALOX5 (0.64) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL7117573 0.72 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL4585385 0.69 ALOX5 (0.62) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL5259316 0.69 NPC1 (0.50) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL5104445 0.69 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL4585395 0.69 ALOX5 (0.61) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL6640438 0.69 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6639737 0.69 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL1993317 0.68 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5443213 0.68 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11ALOX5

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-6316464-B1 P38 MAP kinase inhibitors SYNTEX (U.S.A.) LLC 2001-11-13 US disclosed