⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4655169 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL56380 | 0.77 | — | — | |
| SCHEMBL27495899 | 0.77 | — | — | |
| SCHEMBL2121141 | 0.76 | — | — | |
| SCHEMBL2121145 | 0.76 | — | — | |
| SCHEMBL306582 | 0.74 | — | — | |
| SCHEMBL8167898 | 0.73 | — | — | |
| SCHEMBL56365 | 0.72 | — | — | |
| SCHEMBL3362240 | 0.72 | — | — | |
| SCHEMBL2761586 | 0.72 | — | — |
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-0314435-A2 | Octahydronaphthalene oxime derivatives for cholesterol synthesis inhibition, processes for their preparation and compositions containing them | Sankyo Company Limited (JP) | 1989-05-03 | — | — | EP | disclosed |