SCHEMBL3631017

SCHEMBL3631017

O=C1CC=CC2=C1Sc1ccc[c]c1N2

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
PABPC1 P11940 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL2279059 0.78 GAA (0.51) MEN1GAAMAPTKMT2APABPC1
SCHEMBL1725699 0.72 MEN1 (0.33) MEN1GAAMAPTKMT2APABPC1
SCHEMBL9004464 0.67 KMT2A (0.38) MEN1GAAMAPTKMT2APABPC1
SCHEMBL31213291 0.65 MEN1 (0.36) MEN1GAAMAPTKMT2APABPC1
SCHEMBL2197848 0.65 MEN1 (0.36) MEN1GAAMAPTKMT2APABPC1
SCHEMBL4651 0.62 NOX1 (0.59) MEN1GAAMAPTKMT2APABPC1
SCHEMBL28535050 0.61 NOX1 (0.57) MEN1GAAMAPTKMT2ANPSR1
SCHEMBL28860617 0.61 NOX1 (0.52) MEN1GAAMAPTKMT2APABPC1
SCHEMBL10738447 0.60 GAA (0.42) MEN1GAAMAPTKMT2APABPC1
SCHEMBL6313583 0.60 NOX1 (0.46) MEN1GAAMAPTKMT2APABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10814013-B2 Efficient synthesis of chelators for nuclear imaging and radiotherapy: compositions and applications THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-10-27 US disclosed
EP-2721035-B1 GLIOBLASTOMA INHIBITING COMPOUNDS AND THEIR USE LIFE & BRAIN GMBH (DE) 2018-06-13 EP disclosed
EP-2079486-B1 EFFICIENT SYNTHESIS OF CHELATORS FOR NUCLEAR IMAGING AND RADIOTHERAPY: COMPOSITIONS AND APPLICATIONS UNIV TEXAS (US) 2018-04-04 EP disclosed
US-9573960-B2 Glioblastoma inhibiting compounds and their use LIFE & BRAIN GMBH (DE) 2017-02-21 US disclosed
US-20150148390-A1 GLIOBLASTOMA INHIBITING COMPOUNDS AND THEIR USE LIFE & BRAIN GMBH (DE) 2015-05-28 US disclosed
US-8758723-B2 Compositions and methods for cellular imaging and therapy THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-06-24 US disclosed
CN-103764659-A Glioblastoma inhibiting compounds and their use LIFE AND BRAIN GMBH 2014-04-30 CN disclosed
EP-2721035-A1 GLIOBLASTOMA INHIBITING COMPOUNDS AND THEIR USE Life & Brain GmbH (DE) 2014-04-23 EP disclosed
US-20130039853-A1 EFFICIENT SYNTHESIS OF CHELATORS FOR NUCLEAR IMAGING AND RADIOTHERAPY: COMPOSITIONS AND APPLICATIONS CELL>POINT, LLC 2013-02-14 US disclosed
WO-2012172069-A1 GLIOBLASTOMA INHIBITING COMPOUNDS AND THEIR USE LIFE AND BRAIN GMBH (DE) 2012-12-20 WO disclosed
EP-2146632-A1 COMPOSITIONS AND METHODS FOR CELLULAR IMAGING AND THERAPY The Board of Regents of The University of Texas System (US) 2010-01-27 EP disclosed
EP-2079486-A2 EFFICIENT SYNTHESIS OF CHELATORS FOR NUCLEAR IMAGING AND RADIOTHERAPY: COMPOSITIONS AND APPLICATIONS The Board of Regents of The University of Texas System (US) 2009-07-22 EP disclosed
WO-2009004496-A2 BISANTHRAPYRAZOLES AS ANTI-CANCER AGENTS UNIVERSITY OF MANITOBA (US) 2009-01-08 WO disclosed
WO-2008130439-A1 COMPOSITIONS AND METHODS FOR CELLULAR IMAGING AND THERAPY THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-10-30 WO disclosed
WO-2008045604-A2 EFFICIENT SYNTHESIS OF CHELATORS FOR NUCLEAR IMAGING AND RADIOTHERAPY: COMPOSITIONS AND APPLICATIONS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-04-17 WO disclosed
WO-2007137190-A2 FUNCTIONALLY DIVERSE MACROMOLECULES AND THEIR SYNTHESIS THE TEXAS A & M UNIVERSITY SYSTEM (US) 2007-11-29 WO disclosed
US-20070248537-A1 Compositions and Methods for Cellular Imaging and Therapy THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2007-10-25 US disclosed
US-20070098676-A1 FUNCTIONALLY DIVERSE MACROMOLECULES AND THEIR SYNTHESIS THE TEXAS A&M UNIVERSITY SYSTEM 2007-05-03 US disclosed
US-20070041933-A1 Functionally Diverse Macromolecules and Their Synthesis NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-02-22 US disclosed
US-7034043-B2 Cell adhesion inhibitors BIOGEN IDEC MA INC. (US) 2006-04-25 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 (6 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-20070041933-A1 Functionally Diverse Macromolecules and Their Synthesis ECPAS, PCNA, MRPS22 MEN1 2609/4885GAA 946/4885MAPT 3873/4885
US-10814013-B2 Efficient synthesis of chelators for nuclear imaging and radiotherapy: compositions and applications TNNI3, CAD, TNNT2 MEN1 214/4885GAA 36/4885MAPT 3883/4885
US-20130039853-A1 EFFICIENT SYNTHESIS OF CHELATORS FOR NUCLEAR IMAGING AND RADIOTHERAPY: COMPOSITIONS AND APPLICATIONS TNNI3, CAD, TNNT2 MEN1 214/4885GAA 36/4885MAPT 3883/4885
US-20070098676-A1 FUNCTIONALLY DIVERSE MACROMOLECULES AND THEIR SYNTHESIS ECPAS, PCNA, MRPS22 MEN1 2609/4885GAA 946/4885MAPT 3873/4885
US-20070248537-A1 Compositions and Methods for Cellular Imaging and Therapy H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NCL, NME4 MEN1 34/4885GAA 1806/4885MAPT 2081/4885
US-20150148390-A1 GLIOBLASTOMA INHIBITING COMPOUNDS AND THEIR USE GMFG, GDI1, GDI2 MEN1 708/4885GAA 11/4885MAPT 3518/4885

“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.