SCHEMBL1487648

SCHEMBL1487648

CC(=O)N[C@@H](CS)C(=O)NCCSC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ PTGS2 P35354 1/20 0.49
▸ THPO P40225 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ BLM P54132 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ SIRT6 Q8N6T7 1/20 0.38
▸ SIRT1 Q96EB6 1/20 0.38
▸ FNTA P49354 2/20 0.37
▸ FNTB P49356 2/20 0.37
▸ TSHR P16473 2/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA3 P07451 1/20 0.35
▸ CA4 P22748 1/20 0.35

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
SCHEMBL5967630 0.88 ACE (0.39) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5967612 0.86 KDM4E (0.45) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5967603 0.85 TLR2 (0.39) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5967596 0.85 KDM4E (0.44) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL931196 0.81 KDM4E (0.57) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5967614 0.80 KMT2A (0.48) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL12157363 0.80 KDM4E (0.55) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5967577 0.79 SIRT6 (0.37) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL930076 0.78 KDM4E (0.53) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5967639 0.78 TLR2 (0.37) SIRT6SIRT1TSHRCA12CA1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6989372-B1 Antioxidants, preparation methods and uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2006-01-24 — — US claimed
US-6979747-B2 Antioxidants, preparation processes and their uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2005-12-27 — — US claimed
US-20040158092-A1 Novel antioxidants, preparation processes and their uses OIRY JOEL (FR) 2004-08-12 — — US claimed
EP-1183237-B1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NAT RECH SCIENT (FR) 2004-01-28 — — EP claimed
EP-1183237-A1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2002-03-06 — — EP claimed
WO-2000073266-A1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-12-07 — — WO claimed
US-20230277566-A1 BROAD SPECTRUM ANTIVIRAL AND METHODS OF USE THE BURLINGTON HC RES GROUP INC (US) 2023-09-07 — — US disclosed
US-20210228601-A1 Broad Spectrum Antiviral and Methods of Use THE BURLINGTON HC RES GROUP INC (US) 2021-07-29 — — US disclosed
US-20180344751-A1 Broad Spectrum Antiviral and Methods of Use THE BURLINGTON HC RES GROUP INC (US) 2018-12-06 — — US disclosed
US-9849143-B2 Broad spectrum antiviral and methods of use THE BURLINGTON HC RESEARCH GROUP, INC. (US) 2017-12-26 — — US disclosed
US-20170157151-A1 Broad Spectrum Antiviral and Methods of Use THE BURLINGTON HC RES GROUP INC (US) 2017-06-08 — — US disclosed
US-9585849-B2 Broad spectrum antiviral and methods of use THE BURLINGTON HC RESEARCH GROUP, INC. (US) 2017-03-07 — — US disclosed
US-20160374967-A1 ORGANIC THIOPHOSPHATE ANTIRETROVIRAL AGENTS THE GOVERNMENT OF THE U S A AS REPRESENTED BY THE SECRETARY DEPT OF HEALTH AND HUMAN SERVICES (US) 2016-12-29 — — US disclosed
US-20090239817-A1 ORGANIC THIOPHOSPHATE ANTIRETROVIRAL AGENTS GOVERMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPT OF HEALTH (US) 2009-09-24 — — US disclosed
EP-2010166-A2 ORGANIC THIOPHOSPHATE ANTIRETROVIRAL AGENTS The Government of the United States of America as represented by the Secretary of the Department of Health and Human Services (US) 2009-01-07 — — EP disclosed
WO-2007123868-A2 ORGANIC THIOPHOSPHATE ANTIRETROVIRAL AGENTS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2007-11-01 — — WO disclosed
US-6989372-B1 Antioxidants, preparation methods and uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2006-01-24 — — US disclosed
US-6979747-B2 Antioxidants, preparation processes and their uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2005-12-27 — — US disclosed
US-20040158092-A1 Novel antioxidants, preparation processes and their uses OIRY JOEL (FR) 2004-08-12 — — US disclosed
EP-1183237-B1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NAT RECH SCIENT (FR) 2004-01-28 — — EP 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 (7 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-20210228601-A1 Broad Spectrum Antiviral and Methods of Use MAVS, EIF2AK2, ZC3HAV1 KDM4E 4561/4885MAPT 2984/4885THRB 4374/4885
US-20040158092-A1 Novel antioxidants, preparation processes and their uses GPX1, ACOX1, NAT1 KDM4E 4452/4885MAPT 3015/4885THRB 680/4885
US-20180344751-A1 Broad Spectrum Antiviral and Methods of Use MAVS, EIF2AK2, ZC3HAV1 KDM4E 4561/4885MAPT 2984/4885THRB 4374/4885
US-20160374967-A1 ORGANIC THIOPHOSPHATE ANTIRETROVIRAL AGENTS TYMP, MTAP, TPMT KDM4E 4434/4885MAPT 2773/4885THRB 1728/4885
US-20170157151-A1 Broad Spectrum Antiviral and Methods of Use MAVS, EIF2AK2, ZC3HAV1 KDM4E 4561/4885MAPT 2984/4885THRB 4374/4885
US-20090239817-A1 ORGANIC THIOPHOSPHATE ANTIRETROVIRAL AGENTS TYMP, MTAP, TPMT KDM4E 4434/4885MAPT 2773/4885THRB 1728/4885
US-20230277566-A1 BROAD SPECTRUM ANTIVIRAL AND METHODS OF USE MAVS, EIF2AK2, ZC3HAV1 KDM4E 4561/4885MAPT 2984/4885THRB 4374/4885

“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.

Send feedback