SCHEMBL680549

SCHEMBL680549

CC(C)OC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.71
GSTK1 Q9Y2Q3 1/20 0.71
GLO1 Q04760 2/20 0.51
NOD1 Q9Y239 10/20 0.43
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
PGGT1B P53609 1/20 0.39
FOLH1 Q04609 2/20 0.38

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
SCHEMBL10490002 1.00 PTGS1 (0.71) PTGS1GSTK1GLO1NOD1FNTA
Ethylene Glycol SCHEMBL3625093 0.97 PTGS1 (0.67) PTGS1GSTK1GLO1NOD1FNTA
Sulfuric Acid SCHEMBL7496979 0.96 PTGS1 (0.65) PTGS1GSTK1GLO1NOD1FNTA
Sulfuric Acid SCHEMBL7504984 0.96 PTGS1 (0.65) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL26945939 0.92 PTGS1 (0.67) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL6064367 0.92 PTGS1 (0.70) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL19293541 0.92 PTGS1 (0.59) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL6658547 0.91 PTGS1 (0.57) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL24359832 0.90 PTGS1 (0.67) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL14842415 0.90 PTGS1 (0.67) PTGS1GSTK1GLO1NOD1FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1471903-B1 USE OF GLUTATHIONE SYNTHESIS STIMULATING COMPOUNDS IN REDUCING INSULIN RESISTANCE SCIMAR LTD (CA) 2019-11-20 EP claimed
US-20170002393-A1 COMPOSITIONS AND METHODS FOR ANTIBODY PRODUCTION IMMUNOGEN, INC. (US) 2017-01-05 US claimed
EP-3077522-A1 COMPOSITIONS AND METHODS FOR ANTIBODY PRODUCTION Immunogen, Inc. (US) 2016-10-12 EP claimed
WO-2015085003-A1 COMPOSITIONS AND METHODS FOR ANTIBODY PRODUCTION IMMUNOGEN, INC. (US) 2015-06-11 WO claimed
US-7622447-B2 Use of glutathione synthesis stimulating compounds in reducing insulin resistance DIAMEDICA INC. (CA) 2009-11-24 US claimed
US-20090233995-A1 Use of drug combinations for treating insulin resistance DIAMEDICA INC. (CA) 2009-09-17 US claimed
EP-1758597-A4 USE OF DRUG COMBINATIONS FOR TREATING INSULIN RESISTANCE DIAMEDICA INC (CA) 2008-02-27 EP claimed
US-20070238762-A1 Use of Antagonists of Hepatic Sympathetic Nerve Activity DIAMEDICA INC. (CA) 2007-10-11 US claimed
WO-2007082381-A1 COMPOSITIONS CONTAINING (S)-BETHANECHOL AND THEIR USE IN THE TREATMENT OF INSULIN RESISTANCE, TYPE 2 DIABETES, GLUCOSE INTOLERANCE AND RELATED DISORDERS DIAMEDICA INC. (CA) 2007-07-26 WO claimed
EP-1758597-A1 USE OF DRUG COMBINATIONS FOR TREATING INSULIN RESISTANCE Diamedica Inc. (CA) 2007-03-07 EP claimed
EP-0784471-A4 MULTI-FACETED METHOD TO REPRESS REPRODUCTION OF LATENT VIRUSES IN HUMANS AND ANIMALS DYKE KNOX VAN (US) 1997-11-19 EP claimed
US-5686436-A SUPPRESSING HUMAN IMMUNODEFICIENCY VIRUS, FELINE IMMUNODEFICIENCY VIRUS, FELINE LEUKEMIA VIRUS HIV DIAGNOSTICS, INC. (US) 1997-11-11 US claimed
EP-0784471-A2 MULTI-FACETED METHOD TO REPRESS REPRODUCTION OF LATENT VIRUSES IN HUMANS AND ANIMALS Van Dyke, Knox (US) 1997-07-23 EP claimed
WO-1996010402-A1 MULTI-FACETED METHOD TO REPRESS REPRODUCTION OF LATENT VIRUSES IN HUMANS AND ANIMALS DYKE KNOX VAN (US) 1996-04-11 WO claimed
EP-0647444-A1 L-2-oxothiazolidine-4-carboxylate and other stimulators of intracellular glutathione synthesis for reducing or preventing bone marrow hypoplasia Transcend Therapeutics, Inc. (US) 1995-04-12 EP claimed
EP-0624368-A2 Use of a composition for stimulating the synthesis of glutathione in the manufacture of a medicament for the treatment of acquired immune deficiency syndrome Transcend Therapeutics, Inc. (US) 1994-11-17 EP claimed
WO-1994017799-A1 METHOD FOR TREATING INFERTILITY FREE RADICAL SCIENCES, INC. (US) 1994-08-18 WO claimed
EP-0572110-A2 Method of reducing or preventing toxicity associated with antiretroviral therapy by stimulation of the intracellular gluthatione level Transcend Therapeutics, Inc. (US) 1993-12-01 EP claimed
EP-0501641-A1 L-2-oxothiazolidine-4-carboxylate and glutathion esters for the treatment of hepatic diseases CLINTEC NUTRITION COMPANY (US) 1992-09-02 EP claimed
EP-0494405-A2 Use of thiazolidine-4-carboxylate derivatives for the treatment of pulmonary diseases Transcend Therapeutics, Inc. (US) 1992-07-15 EP claimed

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-20170002393-A1 COMPOSITIONS AND METHODS FOR ANTIBODY PRODUCTION TXNRD1, P4HB, CYBB PTGS1 1016/4885GSTK1 270/4885GLO1 540/4885

“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.