SCHEMBL5599294

SCHEMBL5599294

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

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.63
MAPT P10636 1/20 0.63
THRB P10828 1/20 0.63
ALOX15 P16050 1/20 0.63
NFKB1 P19838 1/20 0.63
PTGS2 P35354 1/20 0.63
THPO P40225 1/20 0.63
RECQL P46063 1/20 0.63
BLM P54132 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
ALDH1A1 P00352 1/20 0.41
ACE P12821 1/20 0.38
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
TACR1 P25103 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33

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
SCHEMBL7999598 1.00 KDM4E (0.63) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL7999610 1.00 KDM4E (0.63) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL6815850 0.94 KDM4E (0.61) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL7646224 0.91 KDM4E (0.53) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL7934243 0.89 KDM4E (0.52) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL14837082 0.88 KDM4E (0.55) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL2298043 0.87 KDM4E (0.63) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL112331 0.87 SMN1; SMN2 (0.63) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL14088106 0.87 SMN1; SMN2 (0.63) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL112332 0.87 SMN1; SMN2 (0.63) KDM4EMAPTTHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105722516-A A method for treating infection, sepsis and injury 低温药理KF有限公司 2016-06-29 CN disclosed
CN-105579045-A A method for organ arrest, protection and preservation and reducing tissue injury HTS THERAPEUTICS PTY LTD 2016-05-11 CN disclosed
US-20160029626-A1 CYSTEINE AMINO-ACID COMPOUND (OR ITS ANALOGUES) USED IN THE DISRUPTION OF MICROBIAL BIOFILMS WHEN TREATING OR PREVENTING DISEASES CAUSED BY PHYTOPATHOGENIC BACTERIA KNOWN TO ATTACK PLANTS OF AGRICULTURAL INTEREST INSTITUTO AGRONOMICO DE CAMPINAS - IAC (BR) 2016-02-04 US disclosed
US-20140030323-A1 CONTROLLED RELEASE OF N-ACETYLCYSTEINE (NAC) FOR REDUCTION OF SYSTEMIC AND/OR VASCULAR INFLAMMATION TIARA PHARMACEUTICALS, INC. (US) 2014-01-30 US disclosed
US-20140030323-A1 CONTROLLED RELEASE OF N-ACETYLCYSTEINE (NAC) FOR REDUCTION OF SYSTEMIC AND/OR VASCULAR INFLAMMATION TIARA PHARMACEUTICALS, INC. (US) 2014-01-30 US disclosed
US-20140024857-A1 CYSTEINE AMINO-ACID COMPOUND (OR ITS ANALOGUES) USED IN THE DISRUPTION OF MICROBIAL BIOFILMS WHEN TREATING OR PREVENTING DISEASES CAUSED BY PHYTOPATHOGENIC BACTERIA KNOWN TO ATTACK PLANTS OF AGRICULTURAL INTEREST INSTITUTO AGRONOMICO DE CAMPINAS - IAC (BR) 2014-01-23 US disclosed
CN-103495173-A Trauma therapy HIBERNATION THERAPEUTICS LTD 2014-01-08 CN disclosed
CN-103493799-A Improved organ protection, preservation and recovery HIBERNATION THERAPEUTICS LTD 2014-01-08 CN disclosed
US-8524772-B2 Controlled release of N-acetylcysteine (NAC) for reduction of systemic and/or vascular inflammation TIARA PHARMACEUTICALS, INC. (US) 2013-09-03 US disclosed
US-8524772-B2 Controlled release of N-acetylcysteine (NAC) for reduction of systemic and/or vascular inflammation TIARA PHARMACEUTICALS, INC. (US) 2013-09-03 US disclosed
WO-2005094862-A1 COMPOSITIONS AND METHOD FOR ALLEVIATING INFLAMMATION AND OXIDATIVE STRESS IN A MAMMAL LIFELINE NUTRACEUTICALS CORPORATION (US) 2005-10-13 WO disclosed
CN-1653125-A Amelioration of the development of cataracts and other ophthalmic diseases OTHERA PHARMACEUTICALS INC (US) 2005-08-10 CN disclosed
EP-1165065-A1 SWALLOWABLE TABLETS WITH HIGH CONTENT OF N-ACETYLCYSTEINE ZAMBON GROUP S.p.A. (IT) 2002-01-02 EP disclosed
EP-1113804-A2 COMBINATIONS OF CHROMIUM OR VANADIUM WITH ANTIDIABETICS FOR GLUCOSE METABOLISM DISORDERS Akesis Pharmaceuticals, Inc. (US) 2001-07-11 EP disclosed
WO-2000059500-A1 SWALLOWABLE TABLETS WITH HIGH CONTENT OF N-ACETYLCYSTEINE ZAMBON GROUP S.P.A. (IT) 2000-10-12 WO disclosed
WO-2000057721-A2 EDIBLE SOLIDS FOR TREATMENT OF GLUCOSE METABOLISM DISORDERS AKESIS PHARMACEUTICALS, INC. (US) 2000-10-05 WO disclosed
WO-2000057729-A2 BEVERAGES FOR TREATMENT OF GLUCOSE METABOLISM DISORDERS AKESIS PHARMACEUTICALS, INC. (US) 2000-10-05 WO disclosed
WO-2000015211-A2 COMPOSITIONS OF CHROMIUM OR VANADIUM WITH ANTIDIABETICS FOR GLUCOSE METABOLISM DISORDERS AKESIS PHARMACEUTICALS, INC. (US) 2000-03-23 WO disclosed
WO-2000007575-A2 METHODS AND COMPOSITIONS FOR INCREASING INSULIN SENSITIVITY MOUNT SINAI HOSPITAL (CA) 2000-02-17 WO disclosed
US-4983513-A QUANTITATIVE ANALYSIS USING LACTATE DEHYDROGENASE BECKMAN INSTRUMENTS, INC. (US) 1991-01-08 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-20140030323-A1 CONTROLLED RELEASE OF N-ACETYLCYSTEINE (NAC) FOR REDUCTION OF SYSTEMIC AND/OR VASCULAR INFLAMMATION IL6, IL1B, NACA KDM4E 4849/4885MAPT 2103/4885THRB 3934/4885

“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.