⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL363478 | 0.65 | — | — | |
| SCHEMBL687303 | 0.62 | — | — | |
| SCHEMBL28286557 | 0.59 | — | — | |
| SCHEMBL9054 | 0.59 | — | — | |
| Norflurane SCHEMBL1173735 | 0.57 | — | — | |
| Norflurane SCHEMBL9499 | 0.57 | — | — | |
| Norflurane SCHEMBL11036325 | 0.57 | — | — | |
| Norflurane SCHEMBL5466910 | 0.57 | — | — | |
| SCHEMBL13449403 | 0.56 | — | — | |
| SCHEMBL1885284 | 0.56 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116410055-A | Continuous production method of hexafluorobutadiene and modified catalyst for production thereof | 浙江科技学院 | 2023-07-11 | — | — | CN | disclosed |
| CN-116082116-A | Continuous production method of perfluorobutene and modified catalyst | 浙江科技学院 | 2023-05-09 | — | — | CN | disclosed |