⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetic Acid Methyl Ester SCHEMBL9773825 | 0.92 | ALDH1A1 (0.83) | — | |
| Acetic Acid Methyl Ester SCHEMBL551844 | 0.92 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL8322448 | 0.91 | ALDH1A1 (1.00) | — | |
| Acetic Acid Methyl Ester SCHEMBL3650 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL3080739 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL23092253 | 0.87 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL5055637 | 0.87 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL1443026 | 0.87 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL6749899 | 0.87 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL21591845 | 0.87 | — | — |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106687436-A | Process for the co-production of acetic acid and dimethyl ether | 英国石油化学品有限公司 | 2017-05-17 | — | — | CN | claimed |
| CN-103506107-A | Catalyst for manufacturing methyl acrylate from methyl acetate and formaldehyde as well as preparation method and application of same | SHANGHAI PUJING CHEMICAL NEW MATERIALS CO LTD | 2014-01-15 | — | — | CN | claimed |
| CN-117986121-A | Methyl methacrylate composition and preparation method thereof | 中国石油化工股份有限公司 | 2024-05-07 | — | — | CN | disclosed |
| CN-113956158-B | Process for synthesizing methyl methacrylate by methyl acetate route | 西南化工研究设计院有限公司 | 2023-03-21 | — | — | CN | disclosed |
| CN-114160190-A | Preparation method and application of dimethyl ether carbonylation catalyst | 西南化工研究设计院有限公司 | 2022-03-11 | — | — | CN | disclosed |
| CN-113956158-A | Process for synthesizing methyl methacrylate by methyl acetate route | 西南化工研究设计院有限公司 | 2022-01-21 | — | — | CN | disclosed |
| CN-110981727-B | Methyl methacrylate synthesis process | 西南化工研究设计院有限公司 | 2020-12-18 | — | — | CN | disclosed |
| CN-109232247-B | Method for preparing methyl methacrylate by aldol condensation of methyl acetate and formaldehyde | 西南化工研究设计院有限公司 | 2020-06-30 | — | — | CN | disclosed |
| CN-110981727-A | Methyl methacrylate synthesis process | 西南化工研究设计院有限公司 | 2020-04-10 | — | — | CN | disclosed |
| CN-107159299-B | Ce-VPO/SBA-15 catalyst and preparation method and application thereof | 江苏大学 | 2019-12-31 | — | — | CN | disclosed |
| CN-109894127-A | A kind of preparation of rare earth phosphate catalyst and its prepare application in acrylic acid (methyl esters) | 中国科学院大连化学物理研究所 | 2019-06-18 | — | — | CN | disclosed |
| CN-103816930-A | Vanadium-phosphorus-oxide (VPO) catalyst and application in preparation of crylic acid (ester) by reacting acetic acid (ester) with formaldehyde | NANJING UNIVERSITY OF TECHNOLOGY | 2014-05-28 | — | — | CN | disclosed |
| CN-103506107-A | Catalyst for manufacturing methyl acrylate from methyl acetate and formaldehyde as well as preparation method and application of same | SHANGHAI PUJING CHEMICAL NEW MATERIALS CO LTD | 2014-01-15 | — | — | CN | disclosed |
| WO-2013116029-A1 | PROCESS FOR PRODUCING DODECANE-1, 12-DIOL BY REDUCTION OF LAURYL LACTONE PRODUCED FROM THE OXIDATION OF CYCLODODECANONE | INVISTAD NORTH AMERICA S.A R.L. (US) | 2013-08-08 | — | — | WO | disclosed |
| CN-102021563-B | Exhaust pipe anticorrosion method for PTA (Pure Terephthalic Acid) production equipment | Shenyang dalu laser technology co ltd | 2012-07-25 | — | — | CN | disclosed |
| US-20110151146-A1 | OPTICAL FILM, ANTI-REFLECTION FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE | KONICA MINOLTA OPTO, INC. (JP) | 2011-06-23 | — | — | US | disclosed |
| CN-102021563-A | Exhaust pipe anticorrosion method for PTA (Pure Terephthalic Acid) production equipment | Shenyang dalu laser technology co ltd | 2011-04-20 | — | — | CN | disclosed |
| EP-1781741-A1 | CURABLE ORGANOPOLYSILOXANE COMPOSITION, METHOD OF CURING THEREOF, SEMICONDUCTOR DEVICE, AND ADHESION PROMOTER | Dow Corning Toray Co., Ltd. (JP) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006011676-A1 | CURABLE ORGANOPOLYSILOXANE COMPOSITION, METHOD OF CURING THEREOF, SEMICONDUCTOR DEVICE, AND ADHESION PROMOTER | DOW CORNING TORAY CO., LTD. (JP) | 2006-02-02 | — | — | WO | disclosed |
| US-3931412-A | Fungus and bacteria control with di-carboxylic acid esters | CHEVRON RESEARCH COMPANY (US) | 1976-01-06 | — | — | US | disclosed |