⚠ 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 | |
|---|---|---|---|---|
| 3-Methylbutanol SCHEMBL28181245 | 0.90 | — | — | |
| 3-Methylbutanol SCHEMBL12054 | 0.89 | — | — | |
| 3-Methylbutanol SCHEMBL901083 | 0.89 | TSHR (0.50) | — | |
| 3-Methylbutanol SCHEMBL8407955 | 0.89 | TSHR (0.50) | — | |
| 3-Methylbutanol SCHEMBL5364827 | 0.87 | TSHR (0.41) | — | |
| 3-Methylbutanol SCHEMBL5564948 | 0.87 | TSHR (0.41) | — | |
| 3-Methylbutanol SCHEMBL28993065 | 0.87 | TSHR (0.41) | — | |
| 3-Methylbutanol SCHEMBL3485868 | 0.87 | TSHR (0.41) | — | |
| 3-Methylbutanol SCHEMBL1317046 | 0.87 | — | — | |
| 3-Methylbutanol SCHEMBL5500556 | 0.87 | TSHR (0.41) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110003143-A | A method of extracting natural Japanese yew alcohol | 云南汉德生物技术有限公司 | 2019-07-12 | — | — | CN | claimed |
| CN-111675679-A | Method for efficiently separating and purifying 10-deacetyl taxol | 云南汉德生物技术有限公司 | 2020-09-18 | — | — | CN | disclosed |
| CN-110003143-A | A method of extracting natural Japanese yew alcohol | 云南汉德生物技术有限公司 | 2019-07-12 | — | — | CN | disclosed |
| EP-1083788-B1 | TRANSGENIC FISH CARRYING A BACTERIOPHAGE-DERIVED TRANSGENE CONSTRUCT FOR MUTATION DETECTION | UNIV GEORGIA RES FOUND (US) | 2005-08-10 | — | — | EP | disclosed |
| US-6307121-B1 | Bacteriophage-based transgenic fish for mutation detection | THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. | 2001-10-23 | — | — | US | disclosed |
| EP-1083788-A1 | BACTERIOPHAGE-BASED TRANSGENIC FISH FOR MUTATION DETECTION | THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 2001-03-21 | — | — | EP | disclosed |
| WO-1999062333-A1 | BACTERIOPHAGE-BASED TRANSGENIC FISH FOR MUTATION DETECTION | THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 1999-12-09 | — | — | WO | disclosed |
| WO-1994003589-A2 | HEPATITIS A VIRUS VACCINE | MERCK & CO., INC. (US) | 1994-02-17 | — | — | WO | disclosed |
| EP-0583142-A2 | Hepatitis A virus vaccine | MERCK & CO. INC. (US) | 1994-02-16 | — | — | EP | disclosed |
| EP-0468702-A2 | Novel process for purification of Hepatitis-A virus capsids | MERCK & CO. INC. (US) | 1992-01-29 | — | — | EP | disclosed |