SCHEMBL13436352

SCHEMBL13436352

C=C(F)c1cc(NC(=O)c2cnc(C)c(-n3cc(-c4cncc(N5CCN(C)CC5)c4)nn3)c2)ccc1OC

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.54

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
SCHEMBL13436420 0.90 BRAF (0.57) BRAF
SCHEMBL15869575 0.88 BRAF (0.60) BRAF
SCHEMBL13436355 0.85 BRAF (0.56) BRAF
SCHEMBL15869552 0.82 BRAF (0.64) BRAF
SCHEMBL13436196 0.82 BRAF (0.60) BRAF
SCHEMBL15869555 0.81 BRAF (0.63) BRAF
SCHEMBL15869642 0.81 BRAF (0.61) BRAF
SCHEMBL2305244 0.79 BRAF (0.59) BRAF
SCHEMBL13436294 0.78 BRAF (0.51) BRAF
SCHEMBL15869599 0.77 BRAF (0.84) 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
WO-2010034838-A2 NEW CHEMICAL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO disclosed