⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29079969 | 0.67 | — | — | |
| SCHEMBL1654113 | 0.67 | — | — | |
| Sulfamate SCHEMBL285371 | 0.64 | — | — | |
| Sulfamate SCHEMBL11400 | 0.64 | — | — | |
| Sulfamate SCHEMBL2545884 | 0.64 | CA1 (1.00) | — | |
| Sulfamide SCHEMBL27676226 | 0.64 | — | — | |
| SCHEMBL11557760 | 0.64 | — | — | |
| SCHEMBL23242 | 0.64 | — | — | |
| SCHEMBL17322206 | 0.64 | — | — | |
| SCHEMBL5893925 | 0.64 | CA1 (0.42) | — |
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-1997046516-A1 | CATALYTIC ASYMMETRIC AMINOHYDROXYLATION OF OLEFINS WITH CARBAMATES | THE SCRIPPS RESEARCH INSTITUTE (US) | 1997-12-11 | — | — | WO | disclosed |