⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22761836 | 0.94 | L3MBTL1 (0.32) | — | |
| SCHEMBL24497023 | 0.81 | — | — | |
| SCHEMBL25143395 | 0.78 | L3MBTL1 (0.30) | — | |
| SCHEMBL627992 | 0.77 | — | — | |
| SCHEMBL10935435 | 0.76 | — | — | |
| SCHEMBL9133050 | 0.75 | — | — | |
| SCHEMBL9488078 | 0.73 | — | — | |
| SCHEMBL29765309 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL593712 | 0.72 | — | — | |
| SCHEMBL812409 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114516954-B | Polyether polyol and polyurethane foam | 红宝丽集团股份有限公司 | 2024-08-20 | — | — | CN | disclosed |
| CN-114516954-A | Polyether polyol and polyurethane foam | 红宝丽集团股份有限公司 | 2022-05-20 | — | — | CN | disclosed |
| US-4310469-A | PHOTOSENSITIVE CURABLE EPOXY RESINS | GENERAL ELECTRIC COMPANY (US) | 1982-01-12 | — | — | US | disclosed |