⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23229558 | 0.68 | — | — | |
| SCHEMBL571031 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL31525200 | 0.66 | — | — | |
| SCHEMBL5864428 | 0.65 | — | — | |
| SCHEMBL5864309 | 0.65 | — | — | |
| SCHEMBL23229554 | 0.64 | — | — | |
| SCHEMBL5864169 | 0.62 | — | — | |
| SCHEMBL13270862 | 0.62 | — | — | |
| SCHEMBL23776119 | 0.61 | ALDH1A1 (0.33) | — | |
| SCHEMBL14440304 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021070800-A1 | ADHESIVE COMPOSITION | 住友化学株式会社 | 2021-04-15 | — | — | WO | disclosed |
| WO-2021070799-A1 | ADHESIVE AGENT COMPOSITION | 住友化学株式会社 | 2021-04-15 | — | — | WO | disclosed |