⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8773848 | 0.67 | — | — | |
| SCHEMBL7058929 | 0.64 | — | — | |
| SCHEMBL6419955 | 0.62 | TSHR (0.41) | — | |
| SCHEMBL28435734 | 0.61 | ALDH1A1 (0.50) | — | |
| SCHEMBL138421 | 0.61 | ALDH1A1 (0.35) | — | |
| SCHEMBL18691180 | 0.56 | — | — | |
| SCHEMBL661517 | 0.56 | — | — | |
| Nitrogen SCHEMBL28826445 | 0.55 | TSHR (0.53) | — | |
| Nitrogen SCHEMBL9312730 | 0.54 | ALDH1A1 (0.57) | — | |
| SCHEMBL26115 | 0.53 | — | — |
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-2141163-A1 | Substituted thiazolidinones, their production and utilisation as medicine | Bayer Schering Pharma AG (DE) | 2010-01-06 | — | — | EP | disclosed |