⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL72799 | 0.84 | — | — | |
| SCHEMBL27812184 | 0.82 | — | — | |
| SCHEMBL11282221 | 0.79 | TSHR (0.31) | — | |
| SCHEMBL27574 | 0.79 | — | — | |
| SCHEMBL4240862 | 0.71 | — | — | |
| SCHEMBL8735139 | 0.71 | — | — | |
| SCHEMBL22443359 | 0.70 | — | — | |
| SCHEMBL2167655 | 0.69 | — | — | |
| SCHEMBL718573 | 0.67 | — | — | |
| Oxirane SCHEMBL4237187 | 0.67 | — | — |
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-0934956-A1 | CURABLE COMPOSITION | KANEKA CORPORATION (JP) | 1999-08-11 | — | — | EP | disclosed |