⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL105950 | 0.77 | — | — | |
| SCHEMBL11579891 | 0.72 | — | — | |
| SCHEMBL107501 | 0.72 | CA1 (0.34) | — | |
| SCHEMBL125411 | 0.71 | — | — | |
| SCHEMBL13837227 | 0.71 | — | — | |
| SCHEMBL10972442 | 0.70 | FFAR3 (0.38) | — | |
| SCHEMBL10602778 | 0.69 | — | — | |
| SCHEMBL10573239 | 0.69 | — | — | |
| SCHEMBL108375 | 0.67 | — | — | |
| SCHEMBL6848810 | 0.67 | — | — |
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-104428331-B | Active energy beam polymer resin composition and the laminated body for using the resin combination | 东洋油墨SC控股株式会社 | 2019-02-15 | — | — | CN | disclosed |