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SCHEMBL1935920

SCHEMBL1935920

COc1c(NC(=O)c2ccc(C)c(Oc3cc(N(C)C4CCN(OC(=O)OC(C)(C)C)CC4)ncn3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 20/20 0.51

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
SCHEMBL2671142 0.91 BRAF (0.51) BRAF
SCHEMBL1936269 0.91 BRAF (0.57) BRAF
SCHEMBL15063012 0.89 BRAF (0.46) BRAF
SCHEMBL1936809 0.88 BRAF (0.56) BRAF
SCHEMBL1936713 0.88 BRAF (0.49) BRAF
SCHEMBL15062961 0.86 BRAF (0.54) BRAF
SCHEMBL15062998 0.85 BRAF (0.46) BRAF
SCHEMBL1935040 0.85 BRAF (0.49) BRAF
SCHEMBL1935832 0.85 BRAF (0.54) BRAF
SCHEMBL15062939 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 3 patents. 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
EP-2331506-A1 NOVEL BENZAMIDES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2011-06-15 — — EP disclosed
WO-2010026095-A1 NOVEL BENZAMIDES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 — — WO disclosed