⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4625392 | 0.89 | PGK1 (0.36) | — | |
| SCHEMBL9475928 | 0.81 | PGK1 (0.33) | — | |
| SCHEMBL481474 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL11599121 | 0.77 | PGK1 (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL11595930 | 0.77 | ALDH1A1 (0.35) | — | |
| SCHEMBL28213088 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL5850760 | 0.72 | PGK1 (0.30) | — | |
| SCHEMBL6057471 | 0.72 | PGK1 (0.30) | — | |
| SCHEMBL6678985 | 0.70 | PGK1 (0.33) | — | |
| SCHEMBL29150567 | 0.69 | ALDH1A1 (0.34) | — |
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-115667365-B | Polyamide resin, polyamide resin composition, and molded article | 三菱瓦斯化学株式会社 | 2024-02-06 | — | — | CN | disclosed |