SCHEMBL8314285

SCHEMBL8314285

c1ccc(Nc2ncnc3cnc(N4CCCC4)nc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.62
EGFR P00533 2/20 0.60
MKNK2 Q9HBH9 1/20 0.50
LMNA P02545 1/20 0.49

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
SCHEMBL8316477 0.89 BRAF (0.64) BRAFEGFRLMNA
SCHEMBL6995917 0.89 BRAF (0.54) BRAFEGFR
SCHEMBL8316744 0.86 BRAF (0.54) BRAFEGFR
SCHEMBL8318927 0.86 LMNA (0.54) BRAFEGFRLMNA
SCHEMBL8320421 0.86 EGFR (0.65) BRAFEGFRLMNA
SCHEMBL8318487 0.86 EGFR (0.65) BRAFEGFR
SCHEMBL6998863 0.85 EGFR (0.54) BRAFEGFRMKNK2
SCHEMBL8314169 0.85 EGFR (0.64) BRAFEGFRLMNA
SCHEMBL8313771 0.83 EGFR (0.65) BRAFEGFRLMNA
SCHEMBL8314998 0.83 BRAF (0.51) BRAFEGFR

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