⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13652408 | 0.67 | — | — | |
| SCHEMBL6938478 | 0.64 | — | — | |
| SCHEMBL12448215 | 0.64 | — | — | |
| SCHEMBL11928896 | 0.63 | — | — | |
| SCHEMBL11928893 | 0.63 | — | — | |
| SCHEMBL12206706 | 0.63 | — | — | |
| SCHEMBL12344956 | 0.63 | — | — | |
| SCHEMBL11928901 | 0.63 | — | — | |
| SCHEMBL9977680 | 0.63 | — | — | |
| SCHEMBL14305173 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005030203-A1 | SUBSTITUTED OXADIAZOLIDINEDIONES ALS PAI-1 INHIBITORS | WYETH (US) | 2005-04-07 | — | — | WO | disclosed |