⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22142667 | 0.78 | — | — | |
| SCHEMBL22142394 | 0.66 | — | — | |
| SCHEMBL22142194 | 0.66 | — | — | |
| SCHEMBL3402859 | 0.66 | — | — | |
| SCHEMBL23958109 | 0.65 | — | — | |
| SCHEMBL20073989 | 0.65 | — | — | |
| SCHEMBL17527104 | 0.64 | — | — | |
| SCHEMBL24836116 | 0.63 | — | — | |
| SCHEMBL13397907 | 0.63 | ALPL (0.33) | — | |
| SCHEMBL18996983 | 0.62 | — | — |
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-3218381-B1 | SPIRO-THIAZOLONES | HOFFMANN LA ROCHE (CH) | 2019-01-23 | — | — | EP | disclosed |