⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9318338 | 0.80 | — | — | |
| SCHEMBL4578155 | 0.76 | ALDH1A1 (0.39) | — | |
| SCHEMBL247410 | 0.72 | — | — | |
| SCHEMBL7599106 | 0.71 | — | — | |
| SCHEMBL11801860 | 0.71 | — | — | |
| SCHEMBL8766236 | 0.69 | — | — | |
| SCHEMBL17123476 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL9331248 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL9931 | 0.69 | — | — | |
| SCHEMBL1760668 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115703698-B | Preparation method of trifluoro vinyl alkyl ether compound and intermediate thereof | 中国科学院上海有机化学研究所 | 2025-01-24 | — | — | CN | claimed |
| US-7247289-B2 | Porous aluminum fluoride | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2007-07-24 | — | — | US | disclosed |
| US-20060025639-A1 | Porous aluminum fluoride | HENGDAO, QUAN (JP) | 2006-02-02 | — | — | US | disclosed |
| JP-2002088006-A | 1-CHLORO-1,1,2,2-TETRAFLUORO-2-METHOXYETHANE AND METHOD FOR PRODUCING THE SAME | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL & TECHNOLOGY | 2002-03-27 | — | — | JP | disclosed |
| JP-2002088006-A | 1-CHLORO-1,1,2,2-TETRAFLUORO-2-METHOXYETHANE AND METHOD FOR PRODUCING THE SAME | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL & TECHNOLOGY | 2002-03-27 | — | — | JP | disclosed |