SCHEMBL8319178

SCHEMBL8319178

COC1CCC(Nc2ncc3ncnc(Nc4cccc(Cl)c4)c3n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.57
HPGD P15428 2/20 0.57
ERBB2 P04626 1/20 0.57
HTT P42858 1/20 0.57
CSNK2A2 P19784 1/20 0.51
CSNK2B P67870 1/20 0.51
CSNK2A1 P68400 1/20 0.51
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 2/20 0.46
FBP1 P09467 2/20 0.46
MEN1 O00255 1/20 0.46
GMNN O75496 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ABL1 P00519 1/20 0.46
LMNA P02545 1/20 0.46
RAF1 P04049 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
GLA P06280 1/20 0.46

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
SCHEMBL8319173 1.00 EGFR (0.57) EGFRHPGDERBB2HTTCSNK2A2
SCHEMBL7142831 0.92 EGFR (0.62) EGFRHPGDERBB2HTTCSNK2A2
SCHEMBL8319095 0.90 EGFR (0.64) EGFRHPGDERBB2HTTCSNK2A1
SCHEMBL8319102 0.90 EGFR (0.64) EGFRHPGDERBB2HTTCSNK2A1
SCHEMBL8314964 0.89 EGFR (0.65) EGFRHPGDERBB2HTT
SCHEMBL8314968 0.89 EGFR (0.65) EGFRHPGDERBB2HTT
SCHEMBL8316366 0.88 EGFR (0.63) EGFRHPGDERBB2HTTCSNK2A1
SCHEMBL8316373 0.88 EGFR (0.63) EGFRHPGDERBB2HTTCSNK2A1
SCHEMBL8316922 0.87 EGFR (0.58) EGFRHPGDERBB2HTTCSNK2A2
SCHEMBL8316918 0.87 EGFR (0.58) EGFRHPGDERBB2HTTCSNK2A2

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