SCHEMBL2234788

SCHEMBL2234788

COc1cc(-c2nc(Nc3ccccc3CO)c3ccccc3n2)cc(OC)c1OC

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 12/20 0.62
KDM1A O60341 1/20 0.61
MAPT P10636 8/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
KDM4E B2RXH2 2/20 0.61
LMNA P02545 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
ALDH1A1 P00352 2/20 0.61
ABCB1 P08183 6/20 0.55
ABCC1 P33527 4/20 0.55
NPSR1 Q6W5P4 1/20 0.53
TP53 P04637 2/20 0.52
SMN1; SMN2 Q16637 1/20 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
SCHEMBL2304172 0.85 KDM1A (0.65) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL2232737 0.83 KDM1A (0.81) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL2296451 0.81 MEN1 (0.54) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL2233756 0.80 MAPT (0.62) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL2232116 0.80 ABCG2 (0.81) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL1083981 0.80 KDM1A (0.66) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL16404294 0.79 ABCG2 (0.86) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL2232368 0.79 KDM1A (0.78) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL2233032 0.79 KDM1A (0.78) ABCG2KDM1AMAPTMEN1KMT2A
SCHEMBL2231161 0.78 KDM1A (0.77) ABCG2KDM1AMAPTMEN1KMT2A

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 2405/4885KDM1A 2957/4885MAPT 2104/4885

“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.