⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15936390 | 0.84 | — | — | |
| Norflurane SCHEMBL15021039 | 0.83 | — | — | |
| Norflurane SCHEMBL15021041 | 0.83 | — | — | |
| Norflurane SCHEMBL5466910 | 0.78 | — | — | |
| SCHEMBL28819 | 0.78 | — | — | |
| SCHEMBL8841031 | 0.78 | — | — | |
| Norflurane SCHEMBL11036325 | 0.78 | — | — | |
| Norflurane SCHEMBL1173735 | 0.78 | — | — | |
| SCHEMBL28820 | 0.78 | — | — | |
| Norflurane SCHEMBL9499 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2643420-B1 | REFRIGERANTS CONTAINING (E)-1,1,1,4,4,4-HEXAFLUOROBUT-2-ENE | ARKEMA FRANCE (FR) | 2014-08-13 | — | — | EP | claimed |