SCHEMBL13459656

SCHEMBL13459656

CC(=O)N1CCN(c2ncc3ncnc(Nc4cc(NC(=O)c5cccc(C(C)(C)N)c5)ccc4C)c3n2)CC1

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.83

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
SCHEMBL13459122 0.93 BRAF (0.88) BRAF
SCHEMBL10119474 0.91 BRAF (1.00) BRAF
SCHEMBL13459654 0.91 BRAF (0.84) BRAF
SCHEMBL10119478 0.91 BRAF (0.79) BRAF
SCHEMBL10119156 0.90 BRAF (0.84) BRAF
SCHEMBL10119012 0.88 BRAF (0.84) BRAF
SCHEMBL13459653 0.88 BRAF (0.84) BRAF
SCHEMBL10118978 0.88 BRAF (0.84) BRAF
SCHEMBL13459153 0.87 BRAF (0.89) BRAF
SCHEMBL10119131 0.87 BRAF (0.89) 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