⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL674291 | 0.73 | — | — | |
| SCHEMBL997452 | 0.70 | — | — | |
| SCHEMBL27624762 | 0.70 | — | — | |
| SCHEMBL17239181 | 0.69 | — | — | |
| SCHEMBL23161022 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL10710402 | 0.67 | PEPD (0.34) | — | |
| SCHEMBL8398198 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL137981 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL4905220 | 0.67 | — | — | |
| SCHEMBL8087707 | 0.65 | — | — |
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-113388116-A | Tackifier, heat-conducting gel, heat-conducting interface material, preparation method and application of heat-conducting interface material, and electronic equipment | 深圳市新纶科技股份有限公司 | 2021-09-14 | — | — | CN | claimed |