⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL105334 | 1.00 | — | — | |
| SCHEMBL862568 | 1.00 | — | — | |
| Water SCHEMBL27388710 | 0.97 | — | — | |
| SCHEMBL28235984 | 0.97 | — | — | |
| SCHEMBL6506163 | 0.97 | — | — | |
| Acetone SCHEMBL28582193 | 0.91 | MAPK1 (0.36) | — | |
| Acetaldehyde SCHEMBL10934614 | 0.91 | — | — | |
| SCHEMBL18268923 | 0.84 | — | — | |
| SCHEMBL577023 | 0.84 | — | — | |
| Butyrolactone SCHEMBL28732820 | 0.83 | CA1 (0.50) | — |
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 176 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101104577-B | Preparation method of 2-ramification of methyl diol in optical purity | SHANGHAI INST ORGANIC CHEM | 2011-06-15 | — | — | CN | claimed |
| CN-101104579-B | Preparation method of 2-ramification of methyl diol in optical purity | SHANGHAI INST ORGANIC CHEM | 2011-06-15 | — | — | CN | claimed |
| CN-101104578-B | Preparation method of 2-ramification of methyl diol in optical purity | SHANGHAI INST ORGANIC CHEM | 2011-06-15 | — | — | CN | claimed |
| CN-100548965-C | ω-the hydroxy-acid derivative of band chirality methyl side chain | SHANGHAI INST ORGANIC CHEM (CN) | 2009-10-14 | — | — | CN | claimed |
| CN-101104577-A | Optically pure methyl halogenated alkyl alcohol derivative | SHANGHAI INST ORGANIC CHEM (CN) | 2008-01-16 | — | — | CN | claimed |
| CN-101104578-A | Optically pure sulfur-containing methyl alkyl alcohol compound | SHANGHAI INST ORGANIC CHEM (CN) | 2008-01-16 | — | — | CN | claimed |
| CN-101104579-A | Optically pure carbonyl substituted alkyl alcohol derivative | SHANGHAI INST ORGANIC CHEM (CN) | 2008-01-16 | — | — | CN | claimed |
| CN-1660766-A | Ramification of omega oxyacid with lateral chain of chirality methyl | SHANGHAI INST ORGANIC CHEM (CN) | 2005-08-31 | — | — | CN | claimed |
| US-4138289-A | ASYMMETRIC HYDROGENATION BY MICROORGANISM, FERMENTATION | HOFFMANN-LA ROCHE INC. (US) | 1979-02-06 | — | — | US | claimed |
| WO-2023234426-A1 | ANTIBODY-MULTIDRUG CONJUGATE | ＵＢＥ株式会社 | 2023-12-07 | — | — | WO | disclosed |
| US-20230382935-A1 | COMPOUND CONTAINING 1,3-DIKETONE LIGAND AND APPLICATION THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE | BEIJING GREEN GUARDEE TECHNOLOGY CO., LTD. (CN) | 2023-11-30 | — | — | US | disclosed |
| US-11656553-B2 | Method for forming semiconductor structure | TAIWAN SEMICONDUCTOR MANUFACTURING COMPANY, LTD. (TW) | 2023-05-23 | — | — | US | disclosed |
| US-20220411390-A1 | MODULATION OF BACTERIAL QUORUM SENSING WITH SYNTHETIC LIGANDS | WISCONSIN ALUMNI RES FOUND (US) | 2022-12-29 | — | — | US | disclosed |
| WO-2022189856-A9 | COMPOUNDS USEFUL FOR TREATING LIVER DISEASES | ABIONYX PHARMA SA (FR) | 2022-10-13 | — | — | WO | disclosed |
| CN-1660766-A | Ramification of omega oxyacid with lateral chain of chirality methyl | SHANGHAI INST ORGANIC CHEM (CN) | 2005-08-31 | — | — | CN | disclosed |
| CN-1660741-A | Optically pure 2-methyl alkyl diol derivative | SHANGHAI INST ORGANIC CHEM (CN) | 2005-08-31 | — | — | CN | disclosed |
| CN-1660741-A | Optically pure 2-methyl alkyl diol derivative | SHANGHAI INST ORGANIC CHEM (CN) | 2005-08-31 | — | — | CN | disclosed |
| CN-1169986-A | 2.9-diamino-and 2-amino-8-carbamoyl-4-hydroxy-aldanoic acid amide derivatives | CIBA GEIGY AG (CH) | 1998-01-14 | — | — | CN | disclosed |
| US-4305876-A | CULTURE PRODUCT INTERMEDIATE IN THE PREPARATION OF VITAMINS E AND K | HOFFMANN-LA ROCHE, INC. (US) | 1981-12-15 | — | — | US | disclosed |
| US-4138289-A | ASYMMETRIC HYDROGENATION BY MICROORGANISM, FERMENTATION | HOFFMANN-LA ROCHE INC. (US) | 1979-02-06 | — | — | US | disclosed |