SCHEMBL183092

SCHEMBL183092

COc1ccc(-c2ccc3ncnc(-c4ccc5c(c4)OCO5)c3c2)cc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 11/20 0.55
CYP1A2 P05177 8/20 0.55
CYP3A4 P08684 8/20 0.55
CYP2D6 P10635 8/20 0.55
CYP2C19 P33261 7/20 0.55
ALDH1A1 P00352 5/20 0.55
HSD17B10 Q99714 5/20 0.55
TSHR P16473 4/20 0.55
LMNA P02545 4/20 0.55
HIF1A Q16665 3/20 0.55
CYP2C9 P11712 3/20 0.55
ALOX15 P16050 2/20 0.55
MAPK1 P28482 4/20 0.54
USP2 O75604 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
RAF1 P04049 2/20 0.52
BRAF P15056 2/20 0.52
KIT P10721 2/20 0.50
CLK1 P49759 4/20 0.49

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
SCHEMBL183411 0.90 PIK3CD (0.58) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL182389 0.90 PIK3CD (0.58) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL182735 0.84 PIK3CD (0.64) CLK4RAF1BRAFKITPIK3CD
SCHEMBL183019 0.84 PIK3CD (0.64) CLK4RAF1BRAFKITPIK3CD
SCHEMBL182570 0.83 PIK3CD (0.58) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL182854 0.83 PIK3CD (0.58) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL182860 0.79 KIT (0.53) RAF1BRAFKITPIK3CDPIK3CA
SCHEMBL6182448 0.77 KIT (0.78) KITPIK3CDPIK3CAPIK3CBMTOR
SCHEMBL3520125 0.76 CLK4 (0.62) CLK4CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL182771 0.76 PIK3CD (0.73) CLK4RAF1BRAFKITPIK3CD

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 586/4885CYP1A2 622/4885CYP3A4 1218/4885

“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.