SCHEMBL13848675

SCHEMBL13848675

COc1c(NC(=O)c2ccc(C)c(N3C=C(c4cnc(C(C)(C)C)[nH]4)NN3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRAF P15056 19/20 0.49
MAPK14 Q16539 1/20 0.44

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
SCHEMBL14298443 0.93 BRAF (0.49) BRAFMAPK14
SCHEMBL13848985 0.91 BRAF (0.47) BRAF
SCHEMBL13848971 0.90 BRAF (0.46) BRAFMAPK14
SCHEMBL13848846 0.90 BRAF (0.48) BRAF
SCHEMBL13848650 0.86 BRAF (0.53) BRAF
SCHEMBL13848669 0.86 BRAF (0.52) BRAF
SCHEMBL13848646 0.85 BRAF (0.49) BRAF
SCHEMBL13887493 0.85 BRAF (0.48) BRAFMAPK14
SCHEMBL13848820 0.85 BRAF (0.49) BRAFMAPK14
SCHEMBL13887556 0.85 BRAF (0.48) BRAF

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-1725544-B1 3-[4-HETEROCYCLYL-1,2,3-TRIAZOL-1-YL]-N-ARYL-BENZAMIDES AS INHIBITORS OF THE CYTOKINES PRODUCTION FOR THE TREATMENT OF CHRONIC INFLAMMATORY DISEASES BOEHRINGER INGELHEIM PHARMA (US) 2009-05-27 EP disclosed