SCHEMBL15062854

SCHEMBL15062854

COc1c(NC(=O)c2ccc(Cl)c(Oc3cc(C(=O)N4CCN(OC(=O)OC(C)(C)C)CC4)ncn3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.43

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
SCHEMBL15062939 0.93 BRAF (0.48) BRAF
SCHEMBL2671151 0.92 BRAF (0.45) BRAF
SCHEMBL1937343 0.88 BRAF (0.47) BRAF
SCHEMBL1936684 0.88 BRAF (0.45) BRAF
SCHEMBL1936805 0.88 LYN (0.47) BRAF
SCHEMBL1935542 0.86 BRAF (0.43) BRAF
SCHEMBL2671185 0.85 BRAF (0.49) BRAF
SCHEMBL2671164 0.84 BRAF (0.51) BRAF
SCHEMBL1934591 0.84 MAPK14 (0.53) BRAF
SCHEMBL1936184 0.83 BRAF (0.57) 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-2331506-B1 NOVEL BENZAMIDES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2013-07-03 EP disclosed