SCHEMBL6993795

SCHEMBL6993795

Fc1ccc(Nc2ncnc3cnc(OC4CCOCC4)nc23)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.61
ERBB2 P04626 2/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
MAPT P10636 1/20 0.51
GRM1 Q13255 1/20 0.50

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
SCHEMBL7093665 0.94 EGFR (0.62) EGFRERBB2HPGDHTT
SCHEMBL8801228 0.91 EGFR (0.58) EGFRERBB2HPGDHTTMAPT
SCHEMBL8319253 0.89 EGFR (0.55) EGFRERBB2HPGDHTTMAPT
SCHEMBL8315690 0.89 EGFR (0.57) EGFRERBB2HPGDHTTMAPT
SCHEMBL8315681 0.89 EGFR (0.57) EGFRERBB2HPGDHTTMAPT
SCHEMBL8319249 0.89 EGFR (0.55) EGFRERBB2HPGDHTTMAPT
SCHEMBL8313801 0.87 EGFR (0.70) EGFRERBB2HPGDHTTMAPT
SCHEMBL8316085 0.86 EGFR (0.55) EGFRERBB2HPGDHTTMAPT
SCHEMBL8316084 0.86 EGFR (0.55) EGFRERBB2HPGDHTTMAPT
SCHEMBL8317623 0.86 EGFR (0.54) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888351-A1 PYRIMIDO 5,4-D]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION Dr. Karl Thomae GmbH (DE) 1999-01-07 EP claimed
WO-1997032880-A1 PYRIMIDO[5,4-D]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION DR. KARL THOMAE GMBH (DE) 1997-09-12 WO claimed
EP-0888351-B1 PYRIMIDO 5,4-D]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION THOMAE GMBH DR K (DE) 2003-10-15 EP disclosed
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
EP-0888351-A1 PYRIMIDO 5,4-D]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION Dr. Karl Thomae GmbH (DE) 1999-01-07 EP disclosed
WO-1997032880-A1 PYRIMIDO[5,4-D]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION DR. KARL THOMAE GMBH (DE) 1997-09-12 WO disclosed