SCHEMBL13459653

SCHEMBL13459653

Cc1ccc(NC(=O)c2cccc(C(C)(C)N)c2)cc1Nc1ncnc2cnc(N3CC[C@@H](F)C3)nc12

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.84

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
SCHEMBL10119012 1.00 BRAF (0.84) BRAF
SCHEMBL13459336 0.94 BRAF (0.90) BRAF
SCHEMBL15478558 0.91 BRAF (1.00) BRAF
SCHEMBL10119163 0.91 BRAF (1.00) BRAF
SCHEMBL10119156 0.89 BRAF (0.84) BRAF
SCHEMBL18874287 0.89 BRAF (0.89) BRAF
SCHEMBL10105300 0.89 BRAF (1.00) BRAF
SCHEMBL10105227 0.89 BRAF (0.89) BRAF
SCHEMBL13459122 0.89 BRAF (0.88) BRAF
SCHEMBL10119478 0.88 BRAF (0.79) 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-2010026262-A1 PYRIDO [5, 4-D] PYRIMIDINES AS CELL PROLIFERATION INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 WO disclosed