SCHEMBL456395

SCHEMBL456395

N[C@@H](CS)C(=O)SC(=O)[C@@H](N)CS

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.55
SLC7A11 Q9UPY5 1/20 0.55
ENPEP Q07075 11/20 0.37
ANPEP P15144 5/20 0.36
MMP2 P08253 1/20 0.34
CPB2 Q96IY4 2/20 0.33
GSR P00390 1/20 0.31

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
SCHEMBL28547750 1.00 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEPMMP2
SCHEMBL29969213 0.87 PTGS1 (0.54) PTGS1SLC7A11ENPEPANPEPMMP2
SCHEMBL2941633 0.83 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEPMMP2
SCHEMBL2941639 0.83 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEPMMP2
SCHEMBL31130601 0.81
SCHEMBL359013 0.81
SCHEMBL28440494 0.81
SCHEMBL2941641 0.81
SCHEMBL8289201 0.80
SCHEMBL29581937 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0739208-A1 FLAVIN DERIVATIVES AS ANTI-VIRAL AGENTS RADOPATH LIMITED (GB) 1996-10-30 EP claimed
WO-1995011028-A1 FLAVIN DERIVATIVES AS ANTI-VIRAL AGENTS RADOPATH LIMITED (GB) 1995-04-27 WO claimed
CN-118201957-A FC binding polypeptides 思拓凡生物工艺研发有限公司 2024-06-14 CN disclosed
CN-118105461-A Treatment of abdominal pain associated with diarrhea predominant irritable bowel syndrome 硬木药品公司 2024-05-31 CN disclosed
CN-117530912-A Stable solid formulations of guanylate cyclase-C receptor agonist polypeptides suitable for oral administration 硬木药品公司 2024-02-09 CN disclosed
EP-4281775-A1 SYSTEMS AND METHODS FOR BIOMOLECULE PREPARATION Nautilus Subsidiary, Inc. (US) 2023-11-29 EP disclosed
EP-3191581-B9 TARGETED MUTAGENESIS IN SPIRULINA LUMEN BIOSCIENCE INC (US) 2023-10-11 EP disclosed
US-20230212322-A1 SYSTEMS AND METHODS FOR BIOMOLECULE PREPARATION NAUTILUS SUBSIDIARY, INC. 2023-07-06 US disclosed
EP-3191581-B1 TARGETED MUTAGENESIS IN SPIRULINA LUMEN BIOSCIENCE INC (US) 2023-06-07 EP disclosed
CN-115089556-A Delayed release compositions of linaclotide 硬木药品公司 2022-09-23 CN disclosed
US-20220227890-A1 SYSTEMS AND METHODS FOR BIOMOLECULE PREPARATION NAUTILUS SUBSIDIARY, INC. 2022-07-21 US disclosed
US-20040009559-A1 Multifunctional recombinant phycobiliprotein-based fluorescent constructs and phycobilisome display THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-01-15 US disclosed
US-6649376-B1 Fusion protein incorporated into macromolecular structure; do not form inclusion bodies; assists folding process; use in labeling THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-11-18 US disclosed
EP-1240314-A4 MULTIFUNCTIONAL RECOMBINANT PHYCOBILIPROTEIN-BASED FLUORESCENT CONSTRUCTS AND PHYCOBILISOME DISPLAY UNIV CALIFORNIA (US) 2003-02-26 EP disclosed
WO-2003012448-A1 ENGINEERING OF LIVING CELLS FOR THE EXPRESSION OF HOLO-PHYCOBILIPROTEIN-BASED CONSTRUCTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-02-13 WO disclosed
US-20030027285-A1 Engineering of living cells for the expression of holo-phycobiliprotein-based constructs ENERGY, U.S. DEPARTMENT OF 2003-02-06 US disclosed
EP-1240314-A1 MULTIFUNCTIONAL RECOMBINANT PHYCOBILIPROTEIN-BASED FLUORESCENT CONSTRUCTS AND PHYCOBILISOME DISPLAY The Regents of the University of California (US) 2002-09-18 EP disclosed
WO-2001046395-A1 MULTIFUNCTIONAL RECOMBINANT PHYCOBILIPROTEIN-BASED FLUORESCENT CONSTRUCTS AND PHYCOBILISOME DISPLAY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-06-28 WO disclosed
US-6051549-A POLYPEPTIDE; ANTITUMOR, ANTICANCER AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2000-04-18 US disclosed
US-5770563-A ANTIPROLIFERATIVE AGENTS, ANTITUMOR AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-06-23 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-20220227890-A1 SYSTEMS AND METHODS FOR BIOMOLECULE PREPARATION PSAP, NPEPPS, VIP PTGS1 3090/4885SLC7A11 4451/4885ENPEP 19/4885

“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.