⚠ 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 | |
|---|---|---|---|---|
| Acetophenone SCHEMBL1404139 | 0.97 | MAPT (0.65) | — | |
| Acetophenone SCHEMBL719033 | 0.97 | MAPT (0.71) | — | |
| Acetophenone SCHEMBL30537000 | 0.97 | — | — | |
| Acetophenone SCHEMBL16745259 | 0.97 | — | — | |
| Acetophenone SCHEMBL1450855 | 0.97 | — | — | |
| Acetophenone SCHEMBL737 | 0.97 | — | — | |
| Acetophenone SCHEMBL27462873 | 0.97 | MAPT (0.71) | — | |
| Acetophenone SCHEMBL30537005 | 0.97 | — | — | |
| Acetophenone SCHEMBL6573416 | 0.94 | MAPT (0.68) | — | |
| Acetophenone SCHEMBL8054906 | 0.94 | MAPT (0.68) | — |
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-117123145-A | Device and method for preparing phenethyl alcohol by acetophenone hydrogenation | 中石化南京工程有限公司 | 2023-11-28 | — | — | CN | disclosed |
| CN-117123145-A | Device and method for preparing phenethyl alcohol by acetophenone hydrogenation | 中石化南京工程有限公司 | 2023-11-28 | — | — | CN | disclosed |
| CN-111905826-B | Preparation method and application of heterogeneous yeast supported chiral metal ruthenium catalyst | 河南师范大学 | 2023-03-31 | — | — | CN | disclosed |
| CN-112898129-A | Application of nitrogen heterocyclic mercaptan cuprous compound in carbonyl compound photocatalytic reaction | 亳州学院 | 2021-06-04 | — | — | CN | disclosed |
| CN-111905826-A | Preparation method and application of heterogeneous yeast supported chiral metal ruthenium catalyst | 河南师范大学 | 2020-11-10 | — | — | CN | disclosed |
| CN-109761777-A | Acetophenone preparation method and system | 江西华尔盛科贸有限公司 | 2019-05-17 | — | — | CN | disclosed |
| CN-104923299-A | Ruthenium catalysts used for catalyzing acetophenone for producing alpha-phenylethanol, and preparation method thereof | UNIV SHENYANG CHEMICAL TECH | 2015-09-23 | — | — | CN | disclosed |
| CN-104923299-A | Ruthenium catalysts used for catalyzing acetophenone for producing alpha-phenylethanol, and preparation method thereof | UNIV SHENYANG CHEMICAL TECH | 2015-09-23 | — | — | CN | disclosed |
| EP-2673326-A2 | COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING | Valspar Sourcing, Inc. (US) | 2013-12-18 | — | — | EP | disclosed |
| EP-2673323-A2 | COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING | Valspar Sourcing, Inc. (US) | 2013-12-18 | — | — | EP | disclosed |
| WO-2012161758-A2 | COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING | VALSPAR SOURCING, INC. (US) | 2012-11-29 | — | — | WO | disclosed |
| WO-2012109278-A2 | COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING | VALSPAR SOURCING, INC. (US) | 2012-08-16 | — | — | WO | disclosed |
| CN-1688324-A | Defensins use as antiviral agents | CIPHERGEN BIOSYSTEMS INC (US) | 2005-10-26 | — | — | CN | disclosed |
| CN-1244854-A | Method for preparing styrenes | HOECHST RES & TECH GMBH & CO (DE) | 2000-02-16 | — | — | CN | disclosed |