⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11098714 | 0.86 | FAAH (0.30) | — | |
| SCHEMBL11052400 | 0.77 | — | — | |
| SCHEMBL11373015 | 0.77 | — | — | |
| SCHEMBL11038120 | 0.76 | — | — | |
| SCHEMBL11039542 | 0.75 | — | — | |
| SCHEMBL10967454 | 0.74 | FAAH (0.33) | — | |
| SCHEMBL11088412 | 0.74 | FAAH (0.33) | — | |
| SCHEMBL11365377 | 0.73 | — | — | |
| SCHEMBL11267554 | 0.71 | — | — | |
| SCHEMBL11220168 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57176982-A | — | — | None | — | — | JP | disclosed |
| JP-S57176982-A | DIOXOLANYLAZETIDINONE COMPOUND, ITS PREPARATION AND USE | SHIONOGI & CO LTD | 1982-10-30 | — | — | JP | disclosed |