⚠ 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 SCHEMBL3207589 | 1.00 | — | — | |
| Fluoride SCHEMBL1539615 | 1.00 | — | — | |
| Fluoride SCHEMBL358568 | 1.00 | — | — | |
| Fluoride SCHEMBL786789 | 1.00 | — | — | |
| Fluoride SCHEMBL94297 | 1.00 | — | — | |
| Fluoride SCHEMBL786791 | 1.00 | — | — | |
| Fluoride SCHEMBL4337958 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL25201374 | 0.82 | — | — | |
| Fluoride SCHEMBL203841 | 0.82 | — | — | |
| Fluoride SCHEMBL4309228 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5073304-A | Adding tetrabromophthalate derivative and water soluble compound to acidic suspension, washing and drying | MARUHACHI MAWATA CO., LTD. (JP) | 1991-12-17 | — | — | US | disclosed |