SCHEMBL8318441

SCHEMBL8318441

CC(=O)N1CCN(c2ncc3ncnc(Nc4cccc(C)c4)c3n2)CC1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.58
BRAF P15056 14/20 0.56
SYK P43405 1/20 0.52

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
SCHEMBL8313771 0.87 EGFR (0.65) EGFRBRAF
SCHEMBL8320421 0.87 EGFR (0.65) EGFRBRAF
SCHEMBL8314169 0.86 EGFR (0.64) EGFRBRAF
SCHEMBL8315543 0.85 BRAF (0.55) EGFRBRAF
SCHEMBL8314587 0.85 EGFR (0.60) EGFRBRAF
SCHEMBL8319361 0.85 EGFR (0.60) EGFRBRAF
SCHEMBL8315976 0.85 EGFR (0.55) EGFRBRAF
SCHEMBL8318909 0.84 BRAF (0.53) EGFRBRAF
SCHEMBL8317888 0.84 EGFR (0.59) EGFRBRAF
SCHEMBL8317894 0.84 EGFR (0.59) EGFRBRAF

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