SCHEMBL8317784

SCHEMBL8317784

C#CCNc1ncc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2n1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.49
ERBB2 P04626 2/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
MAPT P10636 1/20 0.42
STK17A Q9UEE5 2/20 0.41
STK17B O94768 1/20 0.41

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
SCHEMBL8318375 0.91 EGFR (0.61) EGFRERBB2HPGDHTTMAPT
SCHEMBL8316793 0.86 EGFR (0.55) EGFR
SCHEMBL8317687 0.83 EGFR (0.72) EGFRHTT
SCHEMBL8315545 0.82 EGFR (0.72) EGFR
SCHEMBL8316734 0.82 EGFR (0.55) EGFRERBB2MAPTSTK17ASTK17B
SCHEMBL8319402 0.81 EGFR (0.52) EGFRERBB2HPGDHTTMAPT
SCHEMBL8314039 0.81 EGFR (0.52) EGFRERBB2HPGDHTTMAPT
SCHEMBL8317723 0.79 EGFR (0.48) EGFRERBB2HPGDHTTMAPT
SCHEMBL8318470 0.79 EGFR (0.48) EGFRERBB2HPGDHTTMAPT
SCHEMBL8318595 0.79 EGFR (0.48) EGFRERBB2HPGDHTTMAPT

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