SCHEMBL451531

SCHEMBL451531

CCCCCOC(=O)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.54
EPHX1 P07099 1/20 0.50
TSHR P16473 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HCAR2 Q8TDS4 2/20 0.47
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATM Q13315 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 4/20 0.44

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
SCHEMBL3161061 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL30037693 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL29388642 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL30059530 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL666140 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL2477982 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL128589 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
Hydrogen Peroxide SCHEMBL28621940 0.98 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL417576 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL30801428 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113402647-B Regulation and control method and synthesis method of synthetic EVA with controllable release of free radical, EVOH resin and synthesis method thereof 中国科学院长春应用化学研究所 2023-10-13 CN claimed
CN-105886073-B A kind of preparation method of the lubricant tackifier of high shear performance 陕西泽有建设工程有限公司 2018-09-07 CN claimed
CN-108395501-A Norborneol alkenes, vinylene carbonate and perfluoro methyl vinyl ether method for ternary polymerization 宁波工程学院 2018-08-14 CN claimed
CN-107666011-A A kind of nonaqueous electrolytic solution and nonaqueous electrolytic solution secondary battery 微宏动力系统(湖州)有限公司 2018-02-06 CN claimed
CN-105886073-A Preparation method of lubricating oil tackifier with high shear resistance 高明 2016-08-24 CN claimed
CN-105778006-A Modified thermoplastic acrylic resin composition and preparation method thereof 德谦(上海)化学有限公司 2016-07-20 CN claimed
CN-102471553-B Fluorine-containing copolymer composition and method for producing same ASAHI GLASS CO.,LTD. (JP) 2016-02-10 CN claimed
WO-2008013427-A1 ORGANIC TFTS AND METHOD FOR FABRICATING THE SAME LG CHEM, LTD. (KR) 2008-01-31 WO claimed
US-12622893-B2 Alpha2 adrenergic agonist codrugs conjugated with muscarinic agonist drugs ADS THERAPEUTICS LLC 2026-05-12 US disclosed
US-20250171433-A1 A1H-BENZO[C][1,2]THIADIAZINE-2,2-DIOXIDES BEARING HETEROCYCLIC LINKERS AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS GEORGETOWN UNIVERSITY (US) 2025-05-29 US disclosed
WO-2025091719-A1 BINDER, PREPARATION METHOD, NEGATIVE ELECTRODE SLURRY, NEGATIVE ELECTRODE SHEET, SOLID-STATE BATTERY, AND ELECTRIC APPARATUS 宁德时代新能源科技股份有限公司 2025-05-08 WO disclosed
EP-4475845-A1 A1H-BENZO[C][1,2]THIADIAZINE-2,2-DIOXIDES BEARING HETEROCYCLIC LINKERS AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS Georgetown University (US) 2024-12-18 EP disclosed
CN-118973573-A 1H-benzo [ c ] [1,2] thiadiazine-2, 2-dioxides carrying a heterocyclic linker as selective histone deacetylase 6 inhibitors 乔治城大学 2024-11-15 CN disclosed
US-20240216337-A1 ALPHA2 ADRENERGIC AGONIST CODRUGS CONJUGATED WITH MUSCARINIC AGONIST DRUGS ADS THERAPEUTICS LLC 2024-07-04 US disclosed
CN-1076461-A Polyolefin compositions with good transparency and shock strength HIMONT INC (US) 1993-09-22 CN disclosed
CN-1076203-A The polyolefin compositions of heat-sealable HIMONT INC (IT) 1993-09-15 CN disclosed
EP-0545912-A2 1-Biphenylmethylimidazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1993-06-09 EP disclosed
EP-0503785-A1 1-Biphenylimidazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1992-09-16 EP disclosed
CN-1061031-A The crystaline polypropylene polymer composition that heat-seal temperature is low HIMONT INC (US) 1992-05-13 CN disclosed
CN-1040378-A The component and the catalyzer that are used for polymerization of olefines HIMONT INC (US) 1990-03-14 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 (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-20250171433-A1 A1H-BENZO[C][1,2]THIADIAZINE-2,2-DIOXIDES BEARING HETEROCYCLIC LINKERS AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS HDAC1, HDAC6, HDAC11 NAAA 1046/4885EPHX1 2199/4885TSHR 2963/4885
US-20240216337-A1 ALPHA2 ADRENERGIC AGONIST CODRUGS CONJUGATED WITH MUSCARINIC AGONIST DRUGS ADRB2, ADRA2A, ADRA2B NAAA 1692/4885EPHX1 2351/4885TSHR 377/4885
US-12622893-B2 Alpha2 adrenergic agonist codrugs conjugated with muscarinic agonist drugs ADRB2, ADRA1D, ADRB1 NAAA 2810/4885EPHX1 2823/4885TSHR 98/4885

“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.