SCHEMBL6032004

SCHEMBL6032004

Cc1nnc(-c2ccc(-c3cc(C(=O)ONC4CC4)ccc3C)cc2)o1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.59
MAP2K1 Q02750 1/20 0.59
MAPK11 Q15759 2/20 0.58

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
SCHEMBL3072596 0.84 MAPK14 (0.82) MAPK14MAP2K1MAPK11
SCHEMBL5456029 0.79 MAPK14 (0.78) MAPK14MAP2K1MAPK11
SCHEMBL5216405 0.79 MAPK14 (0.57) MAPK14MAP2K1MAPK11
SCHEMBL3423125 0.78 MAPK14 (0.43) MAPK14MAPK11
SCHEMBL3225734 0.78 MAPK14 (0.44) MAPK14MAP2K1MAPK11
SCHEMBL6031999 0.78 MAPK14 (0.59) MAPK14MAP2K1MAPK11
SCHEMBL5122607 0.78 MAPK14 (0.60) MAPK14MAP2K1MAPK11
SCHEMBL5216080 0.77 MAPK14 (0.88) MAPK14MAP2K1MAPK11
SCHEMBL4861254 0.77 MAPK14 (0.67) MAPK14MAP2K1MAPK11
SCHEMBL4865916 0.77 MAPK14 (0.67) MAPK14MAP2K1MAPK11

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1687284-A2 p-38 KINASE INHIBITORS Novartis AG (CH) 2006-08-09 EP disclosed
WO-2005012241-A2 p-38 KINASE INHIBITORS NOVARTIS AG (CH) 2005-02-10 WO disclosed