⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5517191 | 0.96 | CA2 (0.50) | — | |
| SCHEMBL57512 | 0.96 | — | — | |
| SCHEMBL28201315 | 0.92 | — | — | |
| SCHEMBL3964737 | 0.92 | — | — | |
| SCHEMBL27737264 | 0.92 | — | — | |
| SCHEMBL27963485 | 0.92 | — | — | |
| SCHEMBL6363437 | 0.92 | — | — | |
| Water SCHEMBL11567541 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL4007788 | 0.92 | — | — | |
| SCHEMBL28099342 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113697842-A | Method and system for separating and enriching fluorine and/or chlorine from sulfate solution | 江西理工大学 | 2021-11-26 | — | — | CN | disclosed |