⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1493029 | 0.80 | — | — | |
| SCHEMBL9185382 | 0.76 | CYP3A4 (0.33) | — | |
| SCHEMBL3332967 | 0.75 | — | — | |
| SCHEMBL72987 | 0.75 | — | — | |
| SCHEMBL10392629 | 0.74 | — | — | |
| SCHEMBL10392685 | 0.73 | — | — | |
| SCHEMBL15121232 | 0.72 | ALDH1A1 (0.32) | — | |
| SCHEMBL23701207 | 0.72 | — | — | |
| SCHEMBL115101 | 0.72 | — | — | |
| SCHEMBL22444838 | 0.71 | NAAA (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-113056497-A | Multi-layer lacquer construction with improved layer adhesion | 科思创知识产权两合公司 | 2021-06-29 | — | — | CN | disclosed |