SCHEMBL8316972

SCHEMBL8316972

Cc1cccc(Nc2ncnc3cnc(N4CCC(NC(=O)N(C)C)CC4)nc23)c1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.54
BRAF P15056 14/20 0.53
ERBB2 P04626 2/20 0.50
MAPT P10636 1/20 0.47

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
SCHEMBL8315543 0.91 BRAF (0.55) EGFRBRAFERBB2MAPT
SCHEMBL8314521 0.89 BRAF (0.53) EGFRBRAFERBB2MAPT
SCHEMBL8314835 0.88 EGFR (0.56) EGFRBRAFERBB2MAPT
SCHEMBL8315976 0.85 EGFR (0.55) EGFRBRAFERBB2MAPT
SCHEMBL8316302 0.85 EGFR (0.59) EGFRBRAFERBB2MAPT
SCHEMBL8317540 0.84 EGFR (0.57) EGFRBRAFERBB2MAPT
SCHEMBL8316706 0.84 EGFR (0.54) EGFRBRAFERBB2MAPT
SCHEMBL8318605 0.83 EGFR (0.55) EGFRBRAFERBB2MAPT
SCHEMBL8319198 0.83 EGFR (0.56) EGFRBRAFERBB2MAPT
SCHEMBL8317867 0.83 EGFR (0.53) EGFRBRAFERBB2MAPT

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-0779888-B1 PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM BOEHRINGER INGELHEIM PHARMA (DE) 1999-04-28 EP disclosed