SCHEMBL428113

SCHEMBL428113

CC(C)(C)OC(=O)N[C@H](CCC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.61
PPARG P37231 4/20 0.58
ACE P12821 1/20 0.57
PPARD Q03181 2/20 0.53
KLK7 P49862 1/20 0.52
KLK5 Q9Y337 1/20 0.52
SYK P43405 1/20 0.52
CTSS P25774 4/20 0.52
CTSK P43235 3/20 0.51
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
KMT2A Q03164 1/20 0.49
FOLH1 Q04609 1/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL2009896 1.00 PPARA (0.61) PPARAPPARGACEPPARDKLK7
SCHEMBL376018 1.00 PPARA (0.61) PPARAPPARGACEPPARDKLK7
SCHEMBL13702217 0.95 PPARA (0.56) PPARAPPARGACEPPARDKLK7
SCHEMBL13702216 0.95 PPARA (0.56) PPARAPPARGACEPPARDKLK7
Dioxane SCHEMBL27814606 0.93 PPARA (0.54) PPARAPPARGACEPPARDKLK7
SCHEMBL8177426 0.93 PPARA (0.58) PPARAPPARGACEKLK7KLK5
SCHEMBL8178286 0.93 PPARA (0.58) PPARAPPARGACEKLK7KLK5
SCHEMBL1517760 0.93 PPARA (0.55) PPARAPPARGACEKLK7KLK5
SCHEMBL13007476 0.93 PPARA (0.55) PPARAPPARGACEKLK7KLK5
SCHEMBL2011835 0.93 PPARA (0.55) PPARAPPARGACEKLK7KLK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108912007-B Preparation method of dexchloroglutamine 中国农业科学院兰州畜牧与兽药研究所 2021-02-26 CN claimed
WO-2025027624-A1 CYCLIC GLYCOLIPOPEPTIDE VACCINE ADJUVANTS AND THE PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2025-02-06 WO disclosed
US-20240398966-A1 CONJUGATES AND METHODS OF USING THE SAME FLAGSHIP PIONEERING INNOVATIONS V INC (US) 2024-12-05 US disclosed
US-11998610-B2 Conjugates and methods of using the same FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2024-06-04 US disclosed
US-20230382925-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2023-11-30 US disclosed
US-20230382924-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
US-20230382924-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 US disclosed
US-20230382925-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2023-11-30 US disclosed
US-20230382886-A1 CONJUGATED TLR7 AND NOD2 AGONISTS UNIVERZA V LJUBLJANI (SI) 2023-11-30 US disclosed
US-20230374038-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2023-11-23 US disclosed
EP-0259084-B1 CRYSTALLINE N-(S-3-METHYLHEPTANOYL)-D-GAMMA-GLUTAMYL-GLYCYL-D-ALANINE, AND PROCESSES AND INTERMEDIATES THEREFOR PFIZER INC. (US) 1992-07-22 EP disclosed
CN-1017436-B PEPTIDE CONTAINING IMMUNOEXCITANT PFIZER (US) 1992-07-15 CN disclosed
US-4767743-A ANTIINFECTION AGENTS PFIZER INC. (US) 1988-08-30 US disclosed
WO-1988001613-A1 CRYSTALLINE N-(S-3-METHYLHEPTANOYL)-D-GAMMA-GLUTAMYL-GLYCYL-D-ALANINE, AND PROCESSES AND INTERMEDIATES THEREFOR PFIZER INC. (US) 1988-03-10 WO disclosed
WO-1988001612-A1 PROCESSES AND INTERMEDIATES FOR N-(S-3-ALKYL-HEPTANOYL)-D-GAMMA-GLUTAMYL-GLYCYL-D-ALANINE PFIZER INC. (US) 1988-03-10 WO disclosed
EP-0259084-A2 Crystalline N-(S-3-methylheptanoyl)-D-gamma-glutamyl-glycyl-D-alanine, and processes and intermediates therefor PFIZER INC. (US) 1988-03-09 EP disclosed
CN-87105898-A N-(sProcess and intermediates for the preparation of -3-alkylheptanoyl -D-r-glutamyl -glycyl -D-alanyl 1988-03-09 CN disclosed
EP-0258032-A2 Processes and intermediates for N-(S-3-alkylheptanoyl)-D-gamma-glutamyl-glycyl-D-alanine PFIZER INC. (US) 1988-03-02 EP disclosed
EP-0227306-A2 Peptide immunostimulants PFIZER INC. (US) 1987-07-01 EP disclosed
CN-86107931-A PEPTIDE CONTAINING IMMUNOEXCITANT 1987-07-01 CN 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-11998610-B2 Conjugates and methods of using the same CD47, CD44, CD74 PPARA 3022/4885PPARG 3826/4885ACE 1509/4885
US-20230382925-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B PPARA 2055/4885PPARG 1047/4885ACE 3916/4885
US-20230382886-A1 CONJUGATED TLR7 AND NOD2 AGONISTS NOD2, TLR7, TLR9 PPARA 868/4885PPARG 323/4885ACE 4544/4885
US-20230374038-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B PPARA 1776/4885PPARG 903/4885ACE 4062/4885
US-20240398966-A1 CONJUGATES AND METHODS OF USING THE SAME CD47, CD44, CD74 PPARA 3022/4885PPARG 3826/4885ACE 1509/4885
US-20230382924-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B PPARA 2026/4885PPARG 1010/4885ACE 3879/4885

“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.