⚠ 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 | |
|---|---|---|---|---|
| 2,3-Dibromopropanol SCHEMBL10717953 | 1.00 | — | — | |
| 2,3-Dibromopropanol SCHEMBL288971 | 1.00 | — | — | |
| 2,3-Dibromopropanol SCHEMBL9843063 | 0.87 | ALDH1A1 (0.77) | — | |
| 2,3-Dibromopropanol SCHEMBL11862274 | 0.85 | ALDH1A1 (0.72) | — | |
| 2,3-Dibromopropanol SCHEMBL5801545 | 0.83 | ALDH1A1 (0.68) | — | |
| SCHEMBL3419520 | 0.79 | — | — | |
| SCHEMBL66165 | 0.74 | — | — | |
| SCHEMBL622607 | 0.72 | — | — | |
| SCHEMBL28024436 | 0.72 | — | — | |
| SCHEMBL9833377 | 0.72 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120272456-B | Haloalkane dehalogenase mutant and application thereof in degradation of 1,2, 3-tribromopropane | 南京大学 | 2025-08-22 | — | — | CN | disclosed |
| CN-120272456-A | Haloalkane dehalogenase mutant and application thereof in degradation of 1,2, 3-tribromopropane | 南京大学 | 2025-07-08 | — | — | CN | disclosed |
| EP-1550730-B1 | Method for producing optically active 3-chloro-2-methyl-1,2-propanediol taking advantage of microorganism | DAISO CO LTD (JP) | 2007-08-29 | — | — | EP | disclosed |
| US-7235399-B2 | Method for producing optically active 3-chloro-2-methyl-1, 2-propanediol taking advantage of microorganism | DAISO CO., LTD. (JP) | 2007-06-26 | — | — | US | disclosed |
| US-20050153409-A1 | Method for producing optically active 3-chloro-2-methyl-1, 2-propanediol taking advantage of microorganism | OSAKA SODA CO., LTD. (JP) | 2005-07-14 | — | — | US | disclosed |
| EP-1550730-A1 | Method for producing optically active 3-chloro-2-methyl-1,2-propanediol taking advantage of microorganism | DAISO CO., LTD. (JP) | 2005-07-06 | — | — | EP | disclosed |