⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL845600 | 1.00 | — | — | |
| SCHEMBL845602 | 1.00 | — | — | |
| SCHEMBL940715 | 0.93 | CYP2C19 (0.31) | — | |
| SCHEMBL3578695 | 0.93 | CYP2C19 (0.31) | — | |
| SCHEMBL4422891 | 0.85 | — | — | |
| SCHEMBL5072354 | 0.84 | SLC6A1 (0.31) | — | |
| SCHEMBL29549012 | 0.76 | — | — | |
| SCHEMBL4895937 | 0.74 | FFAR3 (0.33) | — | |
| SCHEMBL1966761 | 0.74 | — | — | |
| SCHEMBL6256974 | 0.74 | FFAR3 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0439444-A2 | Synthesis of chiral pyrrolidine and piperidine glycosidase inhibitors | MONSANTO COMPANY (US) | 1991-07-31 | — | — | EP | claimed |
| EP-0439444-A2 | Synthesis of chiral pyrrolidine and piperidine glycosidase inhibitors | MONSANTO COMPANY (US) | 1991-07-31 | — | — | EP | disclosed |
| US-5013842-A | Synthesis of chiral pyrrolidine and piperidine glycosidase inhibitors | MONSANTO COMPANY (US) | 1991-05-07 | — | — | US | disclosed |