⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6043760 | 0.83 | — | — | |
| SCHEMBL8057836 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL1232964 | 0.74 | — | — | |
| SCHEMBL195701 | 0.74 | — | — | |
| SCHEMBL7054054 | 0.72 | — | — | |
| SCHEMBL5422567 | 0.72 | — | — | |
| SCHEMBL467597 | 0.72 | — | — | |
| SCHEMBL10058332 | 0.72 | — | — | |
| SCHEMBL5187333 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL7612838 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5843311-A | Accelerated solvent extraction method | DIONEX CORPORATION (US) | 1998-12-01 | — | — | US | disclosed |
| EP-0713417-A4 | ACCELERATED SOLVENT EXTRACTION SYSTEM | DIONEX CORP (US) | 1997-12-10 | — | — | EP | disclosed |
| EP-0713417-A1 | ACCELERATED SOLVENT EXTRACTION SYSTEM | DIONEX CORPORATION (US) | 1996-05-29 | — | — | EP | disclosed |
| WO-1995034360-A1 | ACCELERATED SOLVENT EXTRACTION SYSTEM | DIONEX CORPORATION (US) | 1995-12-21 | — | — | WO | disclosed |