⚠ 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 SCHEMBL3080739 | 0.95 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL3650 | 0.95 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28296965 | 0.95 | ALDH1A1 (1.00) | — | |
| Acetic Acid Methyl Ester SCHEMBL8322448 | 0.95 | ALDH1A1 (1.00) | — | |
| Acetic Acid Methyl Ester SCHEMBL23092253 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL5055637 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL2992111 | 0.91 | ALDH1A1 (0.91) | — | |
| Acetic Acid Methyl Ester SCHEMBL21591845 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL147887 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL11460432 | 0.91 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102263250-A | Lead-acid cell composite negative plate | — | 2011-11-30 | — | — | CN | claimed |
| CN-109456358-B | Preparation method of organic perovskite nanowire | 浙江工业大学之江学院 | 2021-04-13 | — | — | CN | disclosed |
| EP-3230250-B1 | USE OF PHOSPHATE SALTS IN THE PRODUCTION OF CARBOXYLIC ACIDS | LYONDELLBASELL ACETYLS LLC (US) | 2019-09-25 | — | — | EP | disclosed |
| CN-107180914-B | A kind of preparation method of perovskite thin film battery | 陕西科技大学 | 2019-07-16 | — | — | CN | disclosed |
| CN-109456358-A | A kind of preparation method of organic perovskite nano wire | 浙江工业大学之江学院 | 2019-03-12 | — | — | CN | disclosed |
| CN-108172690-A | A kind of quantum dot solar cell and preparation method thereof | 苏州大学 | 2018-06-15 | — | — | CN | disclosed |
| CN-107365291-A | Oxa- cup [4] aromatic hydrocarbons list schiff bases, synthetic method and its application in copper ion identification | 扬州大学 | 2017-11-21 | — | — | CN | disclosed |
| EP-3230250-A1 | USE OF PHOSPHATE SALTS IN THE PRODUCTION OF CARBOXYLIC ACIDS | Lyondellbasell Acetyls, LLC (US) | 2017-10-18 | — | — | EP | disclosed |
| WO-2016094351-A1 | USE OF PHOSPHATE SALTS IN THE PRODUCTION OF CARBOXYLIC ACIDS | LYONDELLBASELL ACETYLS, LLC (US) | 2016-06-16 | — | — | WO | disclosed |
| US-20160159720-A1 | USE OF PHOSPHATE SALTS IN THE PRODUCTION OF CARBOXYLIC ACIDS | LYONDELLBASELL ACETYLS, LLC (US) | 2016-06-09 | — | — | US | disclosed |
| CN-102263250-A | Lead-acid cell composite negative plate | — | 2011-11-30 | — | — | CN | disclosed |
| CN-102263307-A | Method for pre-charging and pre-discharging lead acid battery adopting composite anode | JILIN HUINENG TECHNOLOGY CO LTD | 2011-11-30 | — | — | CN | disclosed |
| US-6984745-B2 | Environmentally benign lead zirconate titanate ceramic precursor materials | RAYTHEON COMPANY (US) | 2006-01-10 | — | — | US | disclosed |
| US-20050168916-A1 | Environmentally benign lead zirconate titanate ceramic precursor materials | RAYTHEON COMPANY | 2005-08-04 | — | — | US | disclosed |