SCHEMBL2232152

SCHEMBL2232152

COc1ccc(CNc2nc(-c3cc(OC)c(OC)c(OC)c3)nc3ccccc23)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 9/20 0.66
CYP3A4 P08684 9/20 0.66
CYP2D6 P10635 9/20 0.66
CYP2C19 P33261 9/20 0.66
MEN1 O00255 9/20 0.66
KMT2A Q03164 9/20 0.66
TSHR P16473 8/20 0.66
LMNA P02545 8/20 0.66
CYP2C9 P11712 6/20 0.66
USP2 O75604 6/20 0.66
HSD17B10 Q99714 6/20 0.66
MAPK1 P28482 3/20 0.66
CLK4 Q9HAZ1 3/20 0.66
ALDH1A1 P00352 2/20 0.66
APP P05067 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.60
ALOX15 P16050 2/20 0.60
USP1 O94782 1/20 0.60
WDR48 Q8TAF3 1/20 0.60
HIF1A Q16665 1/20 0.59

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
SCHEMBL2231388 0.93 CYP1A2 (0.69) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL1084049 0.91 LMNA (0.69) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL2233241 0.90 MEN1 (0.65) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL12176090 0.87 LMNA (0.72) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL4868213 0.86 MEN1 (0.79) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL2233800 0.86 MEN1 (0.66) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL2232426 0.86 MEN1 (0.66) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL12176088 0.85 LMNA (0.76) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL2291454 0.85 LMNA (0.66) CYP1A2CYP3A4CYP2D6CYP2C19MEN1
SCHEMBL2580707 0.83 MEN1 (0.77) CYP1A2CYP3A4CYP2D6CYP2C19MEN1

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-2528606-B1 QUINAZOLINE-BASED T CELL PROLIFERATION INHIBITORS LEVITZKI ALEXANDER (IL) 2014-09-24 EP disclosed
US-8759363-B2 Quinazoline-based T cell proliferation inhibitors YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2014-06-24 US disclosed
US-20130109706-A1 QUINAZOLINE-BASED T CELL PROLIFERATION INHIBITORS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERSALEM LTD. (IL) 2013-05-02 US disclosed
EP-2528606-A1 QUINAZOLINE-BASED T CELL PROLIFERATION INHIBITORS Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2012-12-05 EP disclosed
WO-2011092695-A1 QUINAZOLINE-BASED T CELL PROLIFERATION INHIBITORS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2011-08-04 WO 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-20130109706-A1 QUINAZOLINE-BASED T CELL PROLIFERATION INHIBITORS IL2, CD4, NFATC1 CYP1A2 477/4885CYP3A4 1083/4885CYP2D6 1571/4885

“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.