⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2210464 | 0.67 | GAA (0.33) | — | |
| Formamide SCHEMBL27805837 | 0.67 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL28029196 | 0.67 | L3MBTL1 (0.34) | — | |
| SCHEMBL298980 | 0.65 | — | — | |
| SCHEMBL14540078 | 0.63 | — | — | |
| SCHEMBL11052633 | 0.63 | — | — | |
| SCHEMBL282505 | 0.62 | — | — | |
| SCHEMBL7876460 | 0.62 | — | — | |
| SCHEMBL349852 | 0.62 | — | — | |
| SCHEMBL5136319 | 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-0069373-A1 | (5R, 6R)-Penem compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1983-01-12 | — | — | EP | disclosed |