SCHEMBL182568

SCHEMBL182568

NC(=O)c1ccc(-c2ncnc3ccc(-c4cnc(N)c(C(F)(F)F)c4)cc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 9/20 0.48
PIK3CD O00329 5/20 0.47
PIK3CB P42338 5/20 0.47
PIK3CG P48736 5/20 0.47
KCNH2 Q12809 1/20 0.47
CYP3A4 P08684 1/20 0.46
MAP4K4 O95819 2/20 0.46
CHEK2 O96017 5/20 0.44
MTOR P42345 1/20 0.43
CD38 P28907 2/20 0.42
MKNK1 Q9BUB5 1/20 0.42
FYN P06241 1/20 0.42
CHEK1 O14757 1/20 0.41
PIK3C3 Q8NEB9 1/20 0.40
PI4KB Q9UBF8 1/20 0.40

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
SCHEMBL183097 0.81 MKNK1 (0.61) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL182887 0.80 PIK3CA (0.61) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL182914 0.75 MKNK1 (0.64) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL182826 0.74 RIPK1 (0.69) PIK3CAPIK3CDPIK3CBPIK3CGMAP4K4
SCHEMBL182555 0.73 MKNK1 (0.66) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL182495 0.73 PIK3CA (0.58) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL183174 0.72 PIK3CA (0.57) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL183031 0.70 MAPK1 (0.48) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL182961 0.70 USP2 (0.50) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2
SCHEMBL182536 0.70 PIK3CA (0.60) PIK3CAPIK3CDPIK3CBPIK3CGKCNH2

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 7 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
CN-101490016-A 2,4-substituted quinazolines as lipid kinase inhibitors NOVARTIS AG (CH) 2009-07-22 CN 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
CN-101490016-A 2,4-substituted quinazolines as lipid kinase inhibitors NOVARTIS AG (CH) 2009-07-22 CN 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.