⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18902415 | 1.00 | — | — | |
| SCHEMBL15692309 | 1.00 | — | — | |
| SCHEMBL18736743 | 0.79 | — | — | |
| SCHEMBL22387274 | 0.73 | MEN1 (0.31) | — | |
| SCHEMBL20231714 | 0.73 | MEN1 (0.31) | — | |
| SCHEMBL18886749 | 0.70 | — | — | |
| SCHEMBL16666507 | 0.70 | — | — | |
| SCHEMBL16659524 | 0.68 | — | — | |
| SCHEMBL8384549 | 0.67 | KDM4E (0.35) | — | |
| SCHEMBL26258627 | 0.67 | KDM4E (0.35) | — |
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-2865666-B1 | HEXAHYDROPENTALENO DERIVATIVES, PREPARATION METHOD AND USE IN MEDICINE THEREOF | SUNSHINE LAKE PHARMA CO LTD (CN) | 2017-05-31 | — | — | EP | disclosed |