⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL782459 | 0.74 | — | — | |
| SCHEMBL12071635 | 0.74 | — | — | |
| SCHEMBL12071063 | 0.74 | — | — | |
| SCHEMBL10079513 | 0.73 | ACACB (0.33) | — | |
| SCHEMBL21357807 | 0.73 | — | — | |
| SCHEMBL21361278 | 0.72 | GAA (0.34) | — | |
| SCHEMBL10079504 | 0.72 | CYP11B2 (0.33) | — | |
| SCHEMBL21357431 | 0.70 | GPR119 (0.40) | — | |
| SCHEMBL10079467 | 0.69 | TSHR (0.36) | — | |
| SCHEMBL10079445 | 0.69 | TSHR (0.34) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11980188-B2 | Spiro cyclohexanedione derivates as herbicides | SYNGENTA PARTICIPATIONS AG (CH) | 2024-05-14 | — | — | US | disclosed |
| CN-111868034-B | Spirocyclic cyclohexanedione derivatives as herbicides | 先正达参股股份有限公司 | 2023-12-01 | — | — | CN | disclosed |
| EP-3765445-B1 | SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2023-08-30 | — | — | EP | disclosed |
| EP-3765445-A1 | SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES | Syngenta Participations AG (CH) | 2021-01-20 | — | — | EP | disclosed |
| US-20210000113-A1 | SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2021-01-07 | — | — | US | disclosed |
| WO-2019175117-A1 | SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2019-09-19 | — | — | WO | disclosed |