SCHEMBL13848846

SCHEMBL13848846

COc1c(NC(=O)c2ccc(C)c(N3C=C(c4cnc(C5CC5)[nH]4)NN3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRAF P15056 19/20 0.48
LYN P07948 1/20 0.46
MAPK9 P45984 1/20 0.46

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 0.90 BRAF (0.49) BRAF
SCHEMBL13848675 0.90 BRAF (0.49) BRAF
SCHEMBL13848985 0.88 BRAF (0.47) BRAF
SCHEMBL13848971 0.86 BRAF (0.46) BRAF
SCHEMBL13848744 0.86 BRAF (0.49) BRAFLYNMAPK9
SCHEMBL13887591 0.85 BRAF (0.48) BRAFLYNMAPK9
SCHEMBL13887496 0.84 BRAF (0.47) BRAFLYNMAPK9
SCHEMBL13887576 0.84 BRAF (0.49) BRAFLYNMAPK9
SCHEMBL13848835 0.83 BRAF (0.48) BRAFLYNMAPK9
SCHEMBL13848725 0.83 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 2 patents. 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
EP-1887003-A1 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 Pharmaceuticals, Inc. (US) 2008-02-13 EP disclosed