⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17375260 | 0.61 | — | — | |
| SCHEMBL16967 | 0.60 | — | — | |
| SCHEMBL6734240 | 0.55 | — | — | |
| SCHEMBL5168892 | 0.55 | — | — | |
| SCHEMBL13784917 | 0.55 | — | — | |
| SCHEMBL13784923 | 0.55 | — | — | |
| SCHEMBL4955525 | 0.53 | — | — | |
| SCHEMBL691682 | 0.53 | — | — | |
| SCHEMBL22186666 | 0.52 | — | — | |
| SCHEMBL17232074 | 0.52 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10392360-B2 | Synthetic route to anhydroryanodol, ryanodol and structural analogues | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2019-08-27 | — | — | US | disclosed |
| US-20180118706-A1 | Synthetic Route To Anhydroryanodol, Ryanodol And Structural Analogues | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2018-05-03 | — | — | US | disclosed |
| US-9862696-B2 | Synthetic route to anhydroryanodol, ryanodol and structural analogues | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2018-01-09 | — | — | US | disclosed |
| WO-2017106649-A1 | SYNTHETIC ROUTE TO ANHYDRORYANODOL, RYANODOL, AND STRUCTURAL ANALOGUES | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2017-06-22 | — | — | WO | disclosed |
| US-20170174648-A1 | Synthetic Route To Anhydroryanodol, Ryanodol And Structural Analogues | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2017-06-22 | — | — | US | disclosed |