⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2897286 | 1.00 | — | — | |
| SCHEMBL15720371 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL2901928 | 0.98 | GBA1 (0.50) | — | |
| SCHEMBL29716692 | 0.81 | — | — | |
| SCHEMBL505753 | 0.81 | — | — | |
| SCHEMBL462864 | 0.81 | — | — | |
| SCHEMBL505465 | 0.81 | — | — | |
| SCHEMBL1313595 | 0.81 | — | — | |
| SCHEMBL462863 | 0.81 | — | — | |
| SCHEMBL505752 | 0.81 | — | — |
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-1860101-B1 | Tartrate sale of isofagomine and methods of use | AMICUS THERAPEUTICS INC (US) | 2011-04-06 | — | — | EP | disclosed |