⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29300101 | 0.81 | — | — | |
| SCHEMBL26240774 | 0.78 | — | — | |
| SCHEMBL29300099 | 0.78 | — | — | |
| SCHEMBL24050467 | 0.78 | — | — | |
| SCHEMBL26238430 | 0.78 | — | — | |
| SCHEMBL8570875 | 0.75 | — | — | |
| SCHEMBL30828912 | 0.73 | — | — | |
| SCHEMBL7751983 | 0.73 | — | — | |
| SCHEMBL9167786 | 0.73 | — | — | |
| SCHEMBL30828910 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1874888-A1 | HEAT TRANSFER AND REFRIGERANT COMPOSITIONS COMPRISING 3,3,4,4,5,5,6,6,6-NONAFLUORO-1-HEXENE AND A FLUOROETHER | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006116372-A1 | HEAT TRANSFER AND REFRIGERANT COMPOSITIONS COMPRISING 3,3,4,4,5,5,6,6,6-NONAFLUORO-1-HEXENE AND A FLUOROETHER | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2006-11-02 | — | — | WO | disclosed |
| CN-1091956-C | Non-aqueous electrolyte and lithium secondary battery | SUMITOMO CHEMICAL CO (JP) | 2002-10-02 | — | — | CN | disclosed |
| CN-1151619-A | Non-aqueous electrolyte and lithium secondary battery | SUMITOMO CHEMICAL CO (JP) | 1997-06-11 | — | — | CN | disclosed |