⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL9823456 | 1.00 | — | — | |
| SCHEMBL11302358 | 1.00 | — | — | |
| SCHEMBL9823603 | 0.97 | — | — | |
| SCHEMBL9161233 | 0.71 | — | — | |
| SCHEMBL8072833 | 0.69 | — | — | |
| SCHEMBL8173097 | 0.69 | — | — | |
| SCHEMBL9639739 | 0.69 | — | — | |
| SCHEMBL9639731 | 0.69 | — | — | |
| SCHEMBL9052205 | 0.69 | — | — | |
| SCHEMBL9753584 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0207894-B1 | HERBICIDALLY ACTIVE DERIVATIVES OF N-PHENYL-3,4,5,6-TETRAHYDROPHTHALIMIDE | CIBA-GEIGY AG (CH) | 1991-11-21 | — | — | EP | claimed |
| CN-108347939-B | Fungicidal compositions containing derivatives of 2, 4-dioxo-1, 4-dihydrothieno [2,3-D ] pyrimidine | 吉利德阿波罗公司 | 2021-09-28 | — | — | CN | disclosed |
| EP-0048108-A1 | Process for making oximinonitriles | ZOECON CORPORATION (US) | 1982-03-24 | — | — | EP | disclosed |
| US-4302402-A | Process for the preparation of oximinonitriles | ZOECON CORPORATION (US) | 1981-11-24 | — | — | US | disclosed |