SCHEMBL195682

SCHEMBL195682

CC(C)OC(=O)N(N)C(=O)OC(C)C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
LMNA P02545 5/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
CA12 O43570 5/20 0.32
CA1 P00915 5/20 0.32
CA2 P00918 5/20 0.32
CA9 Q16790 5/20 0.32
CA7 P43166 3/20 0.32
CA14 Q9ULX7 3/20 0.32
ADRA1A P35348 1/20 0.31
PDE4D Q08499 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL11784789 0.87 TSHR (0.40) TSHRLMNAHTTNPSR1HCAR2
SCHEMBL29703043 0.85 TSHR (0.34) TSHRLMNAHTTNPSR1HCAR2
SCHEMBL24181869 0.82 TSHR (0.36) TSHRCA12CA1CA2CA9
SCHEMBL12006067 0.81
SCHEMBL10676074 0.79 TSHR (0.42) TSHRLMNAHTTNPSR1HCAR2
SCHEMBL28087699 0.77 TSHR (0.40) TSHRLMNAHTTNPSR1HCAR2
SCHEMBL6244866 0.74
SCHEMBL9386609 0.74 TSHR (0.42) TSHRLMNAHTTNPSR1HCAR2
SCHEMBL12988855 0.72 TSHR (0.46) TSHRLMNAHTTNPSR1HCAR2
SCHEMBL9468778 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2012500192-A 2012-01-05 JP claimed
EP-2326642-A2 SALT OF, AND PROCESSES FOR THE PREPARATION OF, 1-ISOPROPYL-4-{[4-(TETRAHYDRO-2H-PYRAN- 4-YLOXY)PHENYL]CARBONYL}HEXAHYDRO-1H-1,4-DIAZEPINE Glaxo Group Limited (GB) 2011-06-01 EP claimed
WO-2010018231-A2 SALT OF, AND PROCESSES FOR THE PREPARATION OF, 1-ISOPROPYL-4-{[4-(TETRAHYDRO-2H-PYRAN- 4-YLOXY)PHENYL]CARBONYL}HEXAHYDRO-1H-1,4-DIAZEPINE GLAXO GROUP LIMITED (GB) 2010-02-18 WO claimed
CN-114929824-B Sealing tape with weak adhesiveness or non-adhesiveness on one side 德莎欧洲股份公司 2025-03-25 CN disclosed
US-12048710-B2 Compositions and methods for modification of biomolecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-07-30 US disclosed
US-20240228451-A1 METHODS OF SYNTHESIZING LIPSTATIN DERIVATIVES PANAFINA, INC. 2024-07-11 US disclosed
EP-4326709-A1 METHODS OF SYNTHESIZING LIPSTATIN DERIVATIVES Panafina, Inc. (US) 2024-02-28 EP disclosed
CN-117279900-A Synthesis method of lipstatin derivatives 帕纳菲娜公司 2023-12-22 CN disclosed
CN-117241803-A Purine nucleosides, intermediates and methods of making the same 阿斯特罗赛特制药公司 2023-12-15 CN disclosed
CN-114630828-B Synthesis of RSV inhibition compound 杨森科学爱尔兰无限公司 2023-10-31 CN disclosed
US-20230151046-A1 5-POSITION MODIFIED PYRIMIDINES NUCLERA LTD (GB) 2023-05-18 US disclosed
US-20080051479-A1 Fluoropolymers And Membranes Prepared From Such Polymers, In Particular For Fuel Cells and Method For Synthesizing Such Polymers COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-02-28 US disclosed
EP-1812031-A2 COMPOSITIONS AND METHODS FOR MODIFICATION OF BIOMOLECULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-08-01 EP disclosed
US-20070078168-A1 PYRIDINE CARBOXYLIC ACID DERIVATIVES AS GLUCOKINASE MODULATORS ASTRAZENECA AB (SE) 2007-04-05 US disclosed
US-20060110782-A1 cycloalkyne compounds reacting with an azide moiety on a target biomolecule, by biochemical conjugation; for its application in vivo (on the cell surface or intracellularly) or in vitro (synthesis of peptides); labeling THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2006-05-25 US disclosed
WO-2006050262-A2 COMPOSITIONS AND METHODS FOR MODIFICATION OF BIOMOLECULES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-05-11 WO disclosed
EP-1023290-A1 SYNTHESIS OF SWAINSONINE SALTS Glycodesign Inc. (CA) 2000-08-02 EP disclosed
WO-1999021858-A1 SYNTHESIS OF SWAINSONINE SALTS GLYCODESIGN INC. (CA) 1999-05-06 WO disclosed
US-4843123-A Cellular thermosetting fluorodiepoxide polymers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1989-06-27 US disclosed
US-4731211-A Cellular thermosetting fluoropolymers and process for making them THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1988-03-15 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 (5 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-12048710-B2 Compositions and methods for modification of biomolecules PTMS, QPCT, ANPEP TSHR 1564/4885LMNA 1871/4885HTT 1834/4885
US-20240228451-A1 METHODS OF SYNTHESIZING LIPSTATIN DERIVATIVES PNLIP, LIPC, LIPE TSHR 2322/4885LMNA 1316/4885HTT 1503/4885
US-20070078168-A1 PYRIDINE CARBOXYLIC ACID DERIVATIVES AS GLUCOKINASE MODULATORS GCK, GCKR, GALK1 TSHR 2945/4885LMNA 3459/4885HTT 3624/4885
US-20230151046-A1 5-POSITION MODIFIED PYRIMIDINES RNGTT, NSUN2, DPYD TSHR 1763/4885LMNA 1539/4885HTT 2710/4885
US-20060110782-A1 cycloalkyne compounds reacting with an azide moiety on a target biomolecule, by biochemical conjugation; for its application in vivo (on the cell surface or intracellularly) or in vitro (synthesis of peptides); labeling PTMS, QPCT, DNPEP TSHR 935/4885LMNA 3610/4885HTT 2699/4885

“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.