SCHEMBL4036414

SCHEMBL4036414

CCC(C)S(=O)(=O)c1ncc(-c2cn(-c3cc(C(=O)Nc4cc(C(C)(C)C)cc(NS(C)(=O)=O)c4OC)ccc3C)nn2)n1C

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 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
SCHEMBL303570 0.91 BRAF (0.48) BRAF
SCHEMBL4032257 0.90 BRAF (0.45) BRAF
SCHEMBL4032253 0.90 BRAF (0.48) BRAF
SCHEMBL302431 0.90 BRAF (0.47) BRAF
SCHEMBL4033522 0.89 BRAF (0.46) BRAF
SCHEMBL301740 0.87 BRAF (0.48) BRAF
SCHEMBL4034272 0.87 BRAF (0.48) BRAF
SCHEMBL4031660 0.87 BRAF (0.45) BRAF
SCHEMBL4033494 0.87 BRAF (0.46) BRAF
SCHEMBL4033874 0.87 BRAF (0.47) 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 claimed