SCHEMBL4288100

SCHEMBL4288100

COC(=O)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.50
ALDH1A1 P00352 3/20 0.39
TET2 Q6N021 1/20 0.37
CA12 O43570 3/20 0.35
CA14 Q9ULX7 3/20 0.35
CA2 P00918 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
CA1 P00915 2/20 0.33
CA7 P43166 2/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
APLNR P35414 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
SCHEMBL78520 0.87 DGAT1 (0.46) DGAT1ALDH1A1CA12CA14CA2
Hydrazine SCHEMBL10794464 0.81 DGAT1 (0.42) DGAT1ALDH1A1CA12CA14CA2
SCHEMBL7440249 0.81 DGAT1 (0.44) DGAT1ALDH1A1TET2CA12CA14
SCHEMBL29233535 0.81 DGAT1 (0.40) DGAT1ALDH1A1TET2CA12CA14
SCHEMBL4147427 0.79 ALDH1A1 (0.44) DGAT1ALDH1A1TET2CA12CA14
SCHEMBL29399642 0.78
SCHEMBL1820007 0.78 ALDH1A1 (0.68) DGAT1ALDH1A1TET2CA12CA14
SCHEMBL1798280 0.78 ALDH1A1 (0.68) DGAT1ALDH1A1TET2CA12CA14
SCHEMBL6950834 0.77 ALDH1A1 (0.56) ALDH1A1TET2CA2GAAEGLN1
SCHEMBL8295 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102234231-B 1-substituted-2-substituted-4- aryl substituted-butyl-2-alkene 1, 4-diketone compound, its preparation method and application SHANGHAI INST MATERIA MEDICA 2015-01-07 CN claimed
CN-103420894-A 2- butane-1,4-diketone compounds, preparation method and applications SHANGHAI INST MATERIA MEDICA 2013-12-04 CN claimed
CN-102234231-A 1-substituted-2-substituted-4- aryl substituted-butyl-2-alkene 1, 4-diketone compound, its preparation method and application SHANGHAI INST MATERIA MEDICA 2011-11-09 CN claimed
CN-1569803-B Process for preparing aryl beta-diketo acid SHANGHAI INST MATERIA MEDICA 2011-04-13 CN claimed
CN-1569803-A Process for preparing aryl beta-diketo acid SHANGHAI INST MATERIA MEDICA (CN) 2005-01-26 CN claimed
EP-4496787-B1 THIOL-OXAMIDE COMPOUNDS AND COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2025-05-28 EP disclosed
US-20250100964-A1 Thiol-Oxamide Compounds and Compositions 3M INNOVATIVE PROPERTIES COMPANY 2025-03-27 US disclosed
EP-4496787-A1 THIOL-OXAMIDE COMPOUNDS AND COMPOSITIONS 3M Innovative Properties Company (US) 2025-01-29 EP disclosed
CN-115427522-B Aqueous resin particle dispersion 爱克发有限公司 2024-05-28 CN disclosed
EP-4237469-B1 CURED ADHESIVE COMPOSITIONS AND METHOD OF MAKING SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2024-05-15 EP disclosed
CN-116390970-B Cured adhesive composition and method of making the same 舒万诺知识产权公司 2024-04-26 CN disclosed
US-11964073-B2 Cured adhesive compositions and method of making 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-04-23 US disclosed
US-20130217693-A1 COMPOUNDS AND METHOD FOR TREATMENT OF HIV CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-08-22 US disclosed
US-20130217693-A1 COMPOUNDS AND METHOD FOR TREATMENT OF HIV CRITICAL OUTCOME TECHNOLOGIES INC. (CA) 2013-08-22 US disclosed
CN-102234231-A 1-substituted-2-substituted-4- aryl substituted-butyl-2-alkene 1, 4-diketone compound, its preparation method and application SHANGHAI INST MATERIA MEDICA 2011-11-09 CN disclosed
CN-1569803-B Process for preparing aryl beta-diketo acid SHANGHAI INST MATERIA MEDICA 2011-04-13 CN disclosed
US-20090088444-A1 Substituted phenanthrene diketo acids and uses therefor BUOLAMWINI JOHN K 2009-04-02 US disclosed
US-20050090668-A1 Preparation of 5-hydroxy-6-oxo-1,6-dihydropyrimidine compounds DREHER SPENCER D (US) 2005-04-28 US disclosed
CN-1569803-A Process for preparing aryl beta-diketo acid SHANGHAI INST MATERIA MEDICA (CN) 2005-01-26 CN disclosed
EP-0286145-A2 3-Heterocyclylthiomethyl cephalosporins SANKEI PHARMACEUTICAL COMPANY LIMITED (JP) 1988-10-12 EP 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 (4 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-20090088444-A1 Substituted phenanthrene diketo acids and uses therefor WEE1, WEE2, HADHB DGAT1 1607/4885ALDH1A1 1119/4885TET2 3552/4885
US-20050090668-A1 Preparation of 5-hydroxy-6-oxo-1,6-dihydropyrimidine compounds DPYD, DHODH, DHPS DGAT1 821/4885ALDH1A1 856/4885TET2 1051/4885
US-20130217693-A1 COMPOUNDS AND METHOD FOR TREATMENT OF HIV NNT, CCR5, XDH DGAT1 3670/4885ALDH1A1 3325/4885TET2 3472/4885
US-20250100964-A1 Thiol-Oxamide Compounds and Compositions TMT1A, TST, SULT1E1 DGAT1 3790/4885ALDH1A1 110/4885TET2 1070/4885

“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.