SCHEMBL2526641

SCHEMBL2526641

COc1ccc(C=Cc2nc3ccccc3s2)cc1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.74
KMT2A Q03164 8/20 0.74
MEN1 O00255 7/20 0.74
RAB9A P51151 4/20 0.74
KDM4E B2RXH2 3/20 0.74
ALDH1A1 P00352 3/20 0.74
HTT P42858 3/20 0.74
POLB P06746 2/20 0.74
GAA P10253 2/20 0.74
SMN1; SMN2 Q16637 4/20 0.58
APP P05067 1/20 0.58
INSR P06213 1/20 0.58
NCOA1 Q15788 1/20 0.58
GLA P06280 2/20 0.56
CYP1A2 P05177 4/20 0.55
CYP1A1 P04798 3/20 0.55
CYP1B1 Q16678 3/20 0.55
NQO2 P16083 1/20 0.55
NPC1 O15118 2/20 0.54
CYP3A4 P08684 1/20 0.54

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
SCHEMBL2526639 1.00 MAPT (0.74) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL9516881 0.88 MAPT (0.66) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL9516889 0.88 MAPT (0.66) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL2830702 0.88 MAPT (0.73) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL23111697 0.88 MAPT (0.77) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL19695963 0.88 MAPT (0.77) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL17576070 0.86 MAPT (0.79) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL16180705 0.86 MAPT (0.79) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL16180704 0.86 MAPT (0.79) MAPTKMT2AMEN1RAB9AKDM4E
SCHEMBL9607131 0.86 MAPT (0.60) MAPTKMT2AMEN1RAB9AKDM4E

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2908843-B1 TREATING CANCER AGENCY SCIENCE TECH & RES (SG) 2019-09-04 EP claimed
US-9889180-B2 Method of treating cancer AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-02-13 US claimed
US-20150258175-A1 METHOD OF TREATING CANCER AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-09-17 US claimed
EP-2908843-A1 METHOD OF TREATING CANCER Agency For Science, Technology And Research (SG) 2015-08-26 EP claimed
WO-2014077784-A1 METHOD OF TREATING CANCER AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-05-22 WO claimed
EP-2908843-B1 TREATING CANCER AGENCY SCIENCE TECH & RES (SG) 2019-09-04 EP disclosed
US-9889180-B2 Method of treating cancer AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-02-13 US disclosed
US-20150258175-A1 METHOD OF TREATING CANCER AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-09-17 US disclosed
EP-2908843-A1 METHOD OF TREATING CANCER Agency For Science, Technology And Research (SG) 2015-08-26 EP disclosed
WO-2014077784-A1 METHOD OF TREATING CANCER AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-05-22 WO disclosed
US-8524682-B2 Compositions and methods for inhibiting EZH2 THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-09-03 US disclosed
US-20110251216-A1 COMPOSITIONS AND METHODS FOR INHIBITING EZH2 THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-10-13 US disclosed
US-20100222420-A1 COMPOSITIONS AND METHODS FOR INHIBITING EZH2 THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-09-02 US disclosed
WO-2009006577-A2 COMPOSITIONS AND METHODS FOR INHIBITING EZH2 THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-01-08 WO disclosed
US-20090012031-A1 EZH2 Cancer Markers THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-01-08 US 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-20110251216-A1 COMPOSITIONS AND METHODS FOR INHIBITING EZH2 EZH2, BMI1, EZH1 MAPT 3335/4885KMT2A 23/4885MEN1 1330/4885

“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.