⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL462863 | 1.00 | — | — | |
| SCHEMBL29716692 | 1.00 | — | — | |
| SCHEMBL505752 | 1.00 | — | — | |
| SCHEMBL1313595 | 1.00 | — | — | |
| SCHEMBL505465 | 1.00 | — | — | |
| SCHEMBL505753 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL2919351 | 0.98 | GBA1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL2919348 | 0.98 | GBA1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL2919353 | 0.98 | GBA1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL2922089 | 0.98 | GBA1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011147951-A1 | CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS | PROSIDION LIMITED (GB) | 2011-12-01 | — | — | WO | disclosed |