⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL611674 | 0.81 | — | — | |
| SCHEMBL159206 | 0.79 | MAOA (0.44) | — | |
| SCHEMBL3169161 | 0.77 | ALDH1A1 (0.42) | — | |
| SCHEMBL6938669 | 0.77 | — | — | |
| SCHEMBL3169832 | 0.77 | — | — | |
| SCHEMBL5755301 | 0.77 | — | — | |
| SCHEMBL1244469 | 0.77 | — | — | |
| SCHEMBL1244286 | 0.77 | — | — | |
| SCHEMBL1167334 | 0.77 | — | — | |
| SCHEMBL128292 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5009986-A | Solubility in organic solvents, durability, compatibility with polymers | TEIJIN LIMITED (JP) | 1991-04-23 | — | — | US | disclosed |
| EP-0379277-A2 | Napthtalocyanine based compound and optical recording medium containing the same | TEIJIN LIMITED (JP) | 1990-07-25 | — | — | EP | disclosed |