SCHEMBL182844

SCHEMBL182844

COc1ccc(-c2ccc3ncnc(-c4ccc(C(=O)N(C)C)cc4)c3c2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 13/20 0.59
CYP3A4 P08684 12/20 0.59
CYP1A2 P05177 12/20 0.59
LMNA P02545 8/20 0.59
CYP2C9 P11712 2/20 0.59
HSD17B10 Q99714 11/20 0.56
ALDH1A1 P00352 10/20 0.56
USP2 O75604 9/20 0.56
CYP2D6 P10635 8/20 0.56
MAPK1 P28482 7/20 0.56
CYP2C19 P33261 6/20 0.56
TSHR P16473 5/20 0.56
PIK3CD O00329 3/20 0.56
PIK3CA P42336 3/20 0.56
PIK3CB P42338 3/20 0.56
PIK3CG P48736 3/20 0.56
KCNH2 Q12809 1/20 0.56
MTOR P42345 1/20 0.54
KDM4E B2RXH2 2/20 0.52
HPGD P15428 2/20 0.52

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
SCHEMBL183208 0.87 PIK3CD (0.58) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL182495 0.87 PIK3CA (0.58) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL183174 0.86 PIK3CA (0.57) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL183018 0.86 PIK3CD (0.57) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL182885 0.84 PIK3CD (0.56) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL182889 0.84 PIK3CD (0.67) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL182536 0.84 PIK3CA (0.60) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL182771 0.83 PIK3CD (0.73) CLK4PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL182628 0.81 MAPK1 (0.57) CLK4HSD17B10ALDH1A1MAPK1TSHR
SCHEMBL182955 0.81 PIK3CD (0.61) CLK4PIK3CDPIK3CAPIK3CBPIK3CG

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 CLK4 586/4885CYP3A4 1218/4885CYP1A2 622/4885

“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.