SCHEMBL79588

SCHEMBL79588

C=C(C(=O)OCC)C(=O)OCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
TSHR P16473 1/20 0.56
MAPT P10636 2/20 0.55
LMNA P02545 1/20 0.48
HSD17B10 Q99714 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
GLO1 Q04760 1/20 0.46
ALOX15 P16050 1/20 0.46
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
SOAT1 P35610 1/20 0.46
CYP2D6 P10635 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
THRB P10828 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
TRPA1 O75762 1/20 0.42
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL28293945 1.00 ALDH1A1 (0.56) ALDH1A1TSHRMAPTLMNAHSD17B10
SCHEMBL28099320 0.97 ALDH1A1 (0.54) ALDH1A1TSHRMAPTLMNAHSD17B10
Ammonia Solution, Strong SCHEMBL28294025 0.97 ALDH1A1 (0.54) ALDH1A1TSHRMAPTLMNAHSD17B10
SCHEMBL13269637 0.94 ALDH1A1 (0.56) ALDH1A1TSHRMAPTLMNAHSD17B10
Acetic Acid SCHEMBL28826956 0.92 ALDH1A1 (0.55) ALDH1A1TSHRMAPTLMNAHSD17B10
Benzene SCHEMBL27784210 0.92 ALDH1A1 (0.66) ALDH1A1TSHRMAPTLMNAHSD17B10
SCHEMBL19679991 0.92 THRB (0.54) ALDH1A1TSHRMAPTLMNAHSD17B10
SCHEMBL6657389 0.90 ALDH1A1 (0.48) ALDH1A1TSHRMAPTLMNAHSD17B10
SCHEMBL14886410 0.88 TSHR (0.53) ALDH1A1TSHRMAPTLMNAHSD17B10
SCHEMBL15536700 0.88 ALDH1A1 (0.47) ALDH1A1TSHRMAPTLMNAHSD17B10

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 1080 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595229-B2 Method for producing derivative of organic substance and method for analyzing sample containing organic substance AJINOMOTO CO., INC. (JP) 2026-04-07 US claimed
CN-119552307-A Preparation method of ester modified SBC carbon five petroleum resin 恒河材料科技股份有限公司 2025-03-04 CN claimed
US-20240374562-A1 METHODS AND COMPOSITIONS COMPRISING A NITRITE-REDUCTASE PROMOTER FOR TREATMENT OF MEDICAL DISORDERS AND PRESERVATION OF BLOOD PRODUCTS EPICENTRX, INC. (US) 2024-11-14 US claimed
US-12005475-B2 Multi-layer curable compositions containing 1,1-di-activated vinyl compound products and related processes PPG INDUSTRIES OHIO, INC. (US) 2024-06-11 US claimed
US-11999866-B2 Polymalonate and cyanoacrylate based surface concrete sealers ZEPHYROS, INC. (US) 2024-06-04 US claimed
EP-3515994-B1 METHOD FOR SEALING POROUS SUBSTRATES ZEPHYROS INC (US) 2024-01-24 EP claimed
CN-114127220-B Curable composition useful for obtaining a non-sensitized cured product 阿科玛法国公司 2024-01-19 CN claimed
US-11859101-B2 Curable compositions containing 1,1-di-activated vinyl compounds and related coatings and processes PPG INDUSTRIES OHIO, INC. (US) 2024-01-02 US claimed
CN-115181277-B Preparation method of metal composite polymer single-chain nano particles 中国科学院化学研究所 2023-12-01 CN claimed
EP-3490724-B1 POLYURETHANE COATING COMPOSITIONS CONTAINING 1,1-DI-ACTIVATED VINYL COMPOUNDS AND RELATED COATINGS AND PROCESSES PPG IND OHIO INC (US) 2023-09-20 EP claimed
US-20080096805-A1 deoxygenated, endotoxin-free and stroma-free transport proteins, incapable of binding with nitric oxide, useful as substitutes for erythrocytes in mammals and for treating disorders where oxygen delivery agents are of benefit IKOR, INC. 2008-04-24 US claimed
CN-101106968-A 2 -C-substituted propane-1, 3 -dicarbonyl compounds and their use in neutralising malodour GIVAUDAN SA (CH) 2008-01-16 CN claimed
US-20060085922-A1 Oxidizing composition comprising at least one electrophilic monomer and at least one non-benzoquinone oxidant L'OREAL S.A. (FR) 2006-04-27 US claimed
EP-1542704-A1 METHOD AND COMPOSITION FOR PREVENTING PAIN IN SICKLE CELL PATIENTS Embury, Stephen H. (US) 2005-06-22 EP claimed
US-20040072796-A1 Method and composition for preventing pain in sickle cell patients TRF PHARMA, INC. 2004-04-15 US claimed
CN-1132818-C 4-oxo-1, 4-dihydro-3-quinolinecarboxamides as antiviral agents PHARMACIA & UPJOHN CO. (US) 2003-12-31 CN claimed
WO-2003088980-A1 METHOD AND COMPOSITION FOR PREVENTING PAIN IN SICKLE CELL PATIENTS EMBURY STEPHEN H (US) 2003-10-30 WO claimed
CN-1332729-A 4-oxo-1,4-dihybro-3-quinolinecarboxamides as antiviral agents PHARMACIA & UP JOHN CO (US) 2002-01-23 CN claimed
EP-0376870-A1 A new organosilylpolyphosphoric reagent, its preparation and application to the process of synthesis of 3-carboxyquinolones or azaquinolones and their salts CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) 1990-07-04 EP claimed
EP-0102404-A1 Novel polycyclic fused pyrazole compounds useful as antiinflammatory agents and preparation thereof STERLING DRUG INC. (US) 1984-03-14 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20060085922-A1 Oxidizing composition comprising at least one electrophilic monomer and at least one non-benzoquinone oxidant KRT18, GPX4, NOX4 ALDH1A1 303/4885TSHR 4243/4885MAPT 2098/4885
US-12595229-B2 Method for producing derivative of organic substance and method for analyzing sample containing organic substance SULT1E1, CNR2, SRMS ALDH1A1 672/4885TSHR 2375/4885MAPT 4797/4885
US-20240374562-A1 METHODS AND COMPOSITIONS COMPRISING A NITRITE-REDUCTASE PROMOTER FOR TREATMENT OF MEDICAL DISORDERS AND PRESERVATION OF BLOOD PRODUCTS HBB, HBG2, HBZ ALDH1A1 1464/4885TSHR 799/4885MAPT 4665/4885

“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.