⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5325333 | 0.78 | — | — | |
| SCHEMBL4415384 | 0.75 | — | — | |
| SCHEMBL15370335 | 0.71 | — | — | |
| SCHEMBL7620432 | 0.71 | — | — | |
| SCHEMBL8640290 | 0.71 | — | — | |
| SCHEMBL12225477 | 0.71 | — | — | |
| SCHEMBL19254914 | 0.69 | CYP2C19 (0.32) | — | |
| SCHEMBL12310674 | 0.69 | — | — | |
| SCHEMBL21375210 | 0.69 | — | — | |
| SCHEMBL12801820 | 0.69 | — | — |
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-115746331-B | Slow-cracking middle-setting asphalt emulsifier for cold recycling, silica modified lignin amine, emulsified asphalt and preparation method thereof | 济南圣泉集团股份有限公司 | 2024-05-10 | — | — | CN | disclosed |
| CN-115746331-A | Slow-breaking and medium-condensing asphalt emulsifier for cold regeneration, silicon dioxide modified lignin amine, emulsified asphalt and preparation method | 济南圣泉集团股份有限公司 | 2023-03-07 | — | — | CN | disclosed |