SCHEMBL4064513

SCHEMBL4064513

CC(C)CN1NN(OS(C)(=O)=O)c2ccc(-c3nc(-c4c(Cl)cccc4Cl)[nH]c3-c3ccc(F)cc3F)nc21

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.53
BRAF P15056 1/20 0.32

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
SCHEMBL4073019 0.86 MAPK14 (0.49) MAPK14
SCHEMBL3994936 0.86 MAPK14 (0.46) MAPK14
SCHEMBL29594312 0.77 MAPK14 (0.68) MAPK14
SCHEMBL4064510 0.77 MAPK14 (0.68) MAPK14
SCHEMBL4063503 0.76 MAPK14 (0.60) MAPK14
SCHEMBL4063498 0.75 MAPK14 (0.67) MAPK14
SCHEMBL29593591 0.75 MAPK14 (0.67) MAPK14
SCHEMBL4067045 0.65 MAPK14 (0.51) MAPK14
SCHEMBL29593300 0.64 MAPK14 (0.67) MAPK14
SCHEMBL4067035 0.64 MAPK14 (0.67) MAPK14

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-1713805-B1 KINASE INHIBITORS LILLY CO ELI (US) 2009-06-10 EP disclosed