SCHEMBL182713

SCHEMBL182713

COc1ccc(-c2ncnc3ccc(-c4ccc(OC)c(OC)c4)cc23)cn1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 10/20 0.66
PIK3CD O00329 9/20 0.66
PIK3CB P42338 9/20 0.66
PIK3CG P48736 8/20 0.66
MTOR P42345 2/20 0.66
KCNH2 Q12809 3/20 0.51
CLK4 Q9HAZ1 1/20 0.48
PDGFRB P09619 2/20 0.48
PDGFRA P16234 2/20 0.48
RAF1 P04049 1/20 0.46
BRAF P15056 1/20 0.46
ENPP1 P22413 2/20 0.46
KIT P10721 2/20 0.45
DYRK1A Q13627 1/20 0.44
ERN1 O75460 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL182967 0.96 PIK3CA (0.68) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182805 0.91 PIK3CD (0.58) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182771 0.88 PIK3CD (0.73) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL6179414 0.87 KIT (0.59) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182889 0.86 PIK3CD (0.67) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL322971 0.84 PIK3CD (0.60) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182933 0.84 PIK3CD (0.61) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182988 0.84 PIK3CD (0.61) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182718 0.83 PIK3CD (0.61) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL182740 0.83 MAP4K4 (0.56) PIK3CAPIK3CDPIK3CBPIK3CGMTOR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049502-B1 2,4-SUBSTITUTED QUINAZOLINES AS LIPID KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-04 EP claimed
US-20090258882-A1 2,4-Substituted Quinazolines as Lipid Kinase Inhibitors NOVARTIS AG 2009-10-15 US claimed
EP-2049502-A1 2,4-SUBSTITUTED QUINAZOLINES AS LIPID KINASE INHIBITORS Novartis AG (CH) 2009-04-22 EP claimed
WO-2008012326-A1 2,4-SUBSTITUTED QUINAZOLINES AS LIPID KINASE INHIBITORS NOVARTIS AG (CH) 2008-01-31 WO claimed
EP-2049502-B1 2,4-SUBSTITUTED QUINAZOLINES AS LIPID KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090258882-A1 2,4-Substituted Quinazolines as Lipid Kinase Inhibitors PDPK1, PI4KA, PIK3CA PIK3CA 3/4885PIK3CD 6/4885PIK3CB 12/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.