⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3121211 | 0.88 | — | — | |
| SCHEMBL5608504 | 0.83 | — | — | |
| SCHEMBL8650848 | 0.82 | — | — | |
| SCHEMBL3110225 | 0.81 | — | — | |
| SCHEMBL5974157 | 0.80 | — | — | |
| SCHEMBL3117824 | 0.80 | TYR (0.34) | — | |
| SCHEMBL3126380 | 0.79 | TYR (0.36) | — | |
| SCHEMBL3116472 | 0.77 | — | — | |
| SCHEMBL3125299 | 0.74 | — | — | |
| SCHEMBL5974682 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0754731-B2 | Polyamide resin composition | MITSUI CHEMICALS INC (JP) | 2004-12-15 | — | — | EP | disclosed |