SCHEMBL18873802

SCHEMBL18873802

Cc1ccc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1Nc1ncnc2cnc(N3CCN(CCO)CC3)nc12

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.88

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
SCHEMBL10105843 0.94 BRAF (1.00) BRAF
SCHEMBL10105348 0.93 BRAF (1.00) BRAF
SCHEMBL10105282 0.91 BRAF (1.00) BRAF
SCHEMBL18873757 0.91 BRAF (0.88) BRAF
SCHEMBL10105392 0.91 BRAF (1.00) BRAF
SCHEMBL10105294 0.90 BRAF (1.00) BRAF
SCHEMBL10105407 0.90 BRAF (1.00) BRAF
SCHEMBL10105316 0.87 BRAF (1.00) BRAF
SCHEMBL18873758 0.86 BRAF (0.85) BRAF
SCHEMBL18874163 0.85 BRAF (0.88) 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-2350083-B1 PYRIMIDO[5,4-D]PYRIMIDINES AS CELL PROLIFERATION INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2017-05-17 EP disclosed