⚠ 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 SCHEMBL6457975 | 0.87 | — | — | |
| Fluoride SCHEMBL27745620 | 0.87 | — | — | |
| Fluoride SCHEMBL27766372 | 0.75 | — | — | |
| Fluoride SCHEMBL27745615 | 0.75 | — | — | |
| Fluoride SCHEMBL22551307 | 0.75 | — | — | |
| Fluoride SCHEMBL4336536 | 0.75 | — | — | |
| Fluoride SCHEMBL4335601 | 0.75 | — | — | |
| Fluoride SCHEMBL4341130 | 0.75 | — | — | |
| Fluoride SCHEMBL786789 | 0.71 | — | — | |
| Fluoride SCHEMBL37068 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4341873-A | Fluorozirconate, glass and the process for making the same | HUGHES AIRCRAFT COMPANY (US) | 1982-07-27 | — | — | US | disclosed |