⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13822426 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL28019190 | 0.91 | — | — | |
| Bromide SCHEMBL28377463 | 0.91 | ALDH1A1 (0.30) | — | |
| SCHEMBL27897182 | 0.90 | — | — | |
| Sulfuric Acid SCHEMBL28435461 | 0.86 | — | — | |
| Sulfuric Acid SCHEMBL28435462 | 0.85 | — | — | |
| SCHEMBL28072435 | 0.85 | MEN1 (0.30) | — | |
| Sulfuric Acid SCHEMBL28122789 | 0.83 | — | — | |
| SCHEMBL28134420 | 0.79 | — | — | |
| SCHEMBL28575418 | 0.78 | — | — |
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-115401622-A | Preparation method of grinding ring for grinding wheel and grinding wheel | 山东大学 | 2022-11-29 | — | — | CN | claimed |