⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL7885135 | 0.87 | — | — | |
| Fluoride SCHEMBL7090993 | 0.87 | — | — | |
| Fluoride SCHEMBL4540893 | 0.82 | — | — | |
| Fluoride SCHEMBL36080 | 0.82 | — | — | |
| Fluoride SCHEMBL1306081 | 0.82 | — | — | |
| SCHEMBL8038953 | 0.82 | — | — | |
| SCHEMBL3580878 | 0.82 | — | — | |
| Fluoride SCHEMBL3226162 | 0.82 | — | — | |
| Fluoride SCHEMBL9278384 | 0.82 | — | — | |
| Fluoride SCHEMBL9130872 | 0.82 | — | — |
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-116637574-A | Process system and method for synthesizing middle-low molecular weight perfluoropolyether | 北京化工大学 | 2023-08-25 | — | — | CN | disclosed |
| US-4297335-A | FLUORINATION OF AN ALUMINUM SILICATE BY A GASEOUS MIXTURE OF FLUORINE, OXYGEN, AND AN INERT GAS; HYDROPHOBIC | UNION CARBIDE CORPORATION (US) | 1981-10-27 | — | — | US | disclosed |