⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL84808 | 0.89 | CHRNA7 (0.48) | — | |
| SCHEMBL6657817 | 0.89 | CHRNA7 (0.48) | — | |
| SCHEMBL262312 | 0.89 | — | — | |
| SCHEMBL577415 | 0.89 | CHRNA7 (0.48) | — | |
| SCHEMBL577052 | 0.89 | CHRNA7 (0.48) | — | |
| Hydrochloric Acid SCHEMBL14482129 | 0.85 | CHRNA7 (0.46) | — | |
| Iodide SCHEMBL11554007 | 0.85 | CHRNA7 (0.46) | — | |
| Ammonia Solution, Strong SCHEMBL4249875 | 0.85 | — | — | |
| Trimethylammonium SCHEMBL27667041 | 0.84 | KMT2A (0.46) | — | |
| SCHEMBL684086 | 0.82 | ALDH1A1 (0.40) | — |
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-20240315942-A1 | DELIVERY OF SURFACTANT SOLUBLE AGENT | PROCTER & GAMBLE (US) | 2024-09-26 | — | — | US | disclosed |