⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28482912 | 0.97 | — | — | |
| SCHEMBL11568816 | 0.84 | — | — | |
| SCHEMBL27629418 | 0.82 | — | — | |
| SCHEMBL27822760 | 0.82 | FDPS (0.32) | — | |
| SCHEMBL664449 | 0.80 | — | — | |
| SCHEMBL2576163 | 0.78 | — | — | |
| SCHEMBL1326213 | 0.77 | — | — | |
| SCHEMBL27778646 | 0.76 | — | — | |
| SCHEMBL28154960 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL2469669 | 0.74 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106497500-A | A kind of structure glue and preparation method thereof | 嘉善天胶装饰材料有限公司 | 2017-03-15 | — | — | CN | disclosed |
| EP-0000683-A1 | Method of producing coated glass fibres, coated fibres and their use for the reinforcement of plastics. | SAINT-GOBAIN INDUSTRIES (FR) | 1979-02-07 | — | — | EP | disclosed |