⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8521755 | 0.90 | — | — | |
| SCHEMBL8522062 | 0.89 | — | — | |
| SCHEMBL8522324 | 0.89 | APLNR (0.31) | — | |
| SCHEMBL8521278 | 0.88 | — | — | |
| SCHEMBL8306226 | 0.86 | — | — | |
| SCHEMBL8520844 | 0.86 | — | — | |
| SCHEMBL8521606 | 0.84 | — | — | |
| SCHEMBL8521808 | 0.83 | BRS3 (0.32) | — | |
| SCHEMBL8304979 | 0.83 | — | — | |
| SCHEMBL8303502 | 0.81 | — | — |
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-0936221-A1 | NOVEL 2,4-DIOXOPYRROLIDINE AND 2,4-DIOXOTETRAHYDROFURAN DERIVATIVES AND MEDICINES CONTAINING THE SAME AS THE ACTIVE INGREDIENT | LEAD CHEMICAL COMPANY LTD. (JP) | 1999-08-18 | — | — | EP | disclosed |