SCHEMBL2296472

SCHEMBL2296472

Cc1ccc(Nc2nc(-c3cc(O)c(O)c(O)c3)nc3ccccc23)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 8/20 0.74
MAPT P10636 5/20 0.74
TP53 P04637 2/20 0.74
LMNA P02545 1/20 0.74
MEN1 O00255 7/20 0.73
KMT2A Q03164 7/20 0.73
GBA1 P04062 1/20 0.73
KDM4E B2RXH2 1/20 0.67
ALDH1A1 P00352 1/20 0.67
RXFP1 Q9HBX9 1/20 0.67
GAA P10253 2/20 0.65
NTSR1 P30989 1/20 0.65
MAPK1 P28482 2/20 0.63
HTT P42858 1/20 0.63
RORC P51449 1/20 0.60
MAPK14 Q16539 1/20 0.60
ABCB1 P08183 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
PDE5A O76074 1/20 0.57
NPY5R Q15761 1/20 0.56

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
SCHEMBL2296338 0.91 ABCG2 (0.70) ABCG2MAPTTP53LMNAMEN1
SCHEMBL2294276 0.90 ABCG2 (0.78) ABCG2MAPTTP53LMNAMEN1
SCHEMBL2299801 0.88 ABCG2 (0.74) ABCG2MAPTTP53LMNAMEN1
SCHEMBL2294947 0.87 ABCG2 (0.76) ABCG2MAPTTP53LMNAMEN1
SCHEMBL8095812 0.85 ABCG2 (1.00) ABCG2MAPTTP53LMNAMEN1
SCHEMBL22201364 0.85 ABCG2 (0.94) ABCG2MAPTTP53LMNAMEN1
SCHEMBL2291715 0.84 MEN1 (0.67) ABCG2MAPTTP53LMNAMEN1
SCHEMBL5531993 0.83 ABCG2 (0.89) ABCG2MAPTTP53LMNAMEN1
SCHEMBL1083802 0.82 MEN1 (0.81) ABCG2MAPTTP53LMNAMEN1
SCHEMBL2231290 0.82 ABCG2 (0.55) ABCG2MAPTTP53MEN1KMT2A

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 ABCG2 2405/4885MAPT 2104/4885TP53 174/4885

“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.