SCHEMBL18874201

SCHEMBL18874201

Cc1ccc(C(=O)NC(=N)/C=C(\O)C(C)(C)C)cc1Nc1ncnc2cnc(NC3CC(N4CCN(C)CC4)C3)nc12

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.63

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
SCHEMBL18873759 0.89 BRAF (0.69) BRAF
SCHEMBL18873725 0.85 BRAF (0.63) BRAF
SCHEMBL18873745 0.85 BRAF (0.68) BRAF
SCHEMBL18873815 0.85 BRAF (0.69) BRAF
SCHEMBL10105931 0.81 BRAF (0.79) BRAF
SCHEMBL18873771 0.81 BRAF (0.64) BRAF
SCHEMBL18873727 0.80 BRAF (0.65) BRAF
SCHEMBL18874169 0.80 BRAF (0.68) BRAF
SCHEMBL18873918 0.79 BRAF (0.65) BRAF
SCHEMBL18874329 0.79 BRAF (0.69) 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