⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25636802 | 0.82 | TSHR (0.44) | — | |
| SCHEMBL6399938 | 0.80 | EP300 (0.30) | — | |
| SCHEMBL547287 | 0.74 | TSHR (0.52) | — | |
| SCHEMBL19261603 | 0.74 | TSHR (0.52) | — | |
| SCHEMBL18709094 | 0.74 | — | — | |
| SCHEMBL6396791 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL20013885 | 0.69 | — | — | |
| SCHEMBL21504667 | 0.69 | — | — | |
| SCHEMBL786684 | 0.68 | TSHR (0.48) | — | |
| SCHEMBL9913281 | 0.68 | TSHR (0.34) | — |
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-1873143-B1 | A salt suitable for an acid generator and a chemically amplified resist composition containing the same | SUMITOMO CHEMICAL CO (JP) | 2009-04-15 | — | — | EP | disclosed |