⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15354994 | 0.86 | — | — | |
| SCHEMBL1060050 | 0.72 | — | — | |
| SCHEMBL326285 | 0.72 | — | — | |
| SCHEMBL767257 | 0.72 | — | — | |
| SCHEMBL887928 | 0.71 | — | — | |
| SCHEMBL12796466 | 0.69 | — | — | |
| SCHEMBL1357608 | 0.69 | — | — | |
| Ammonia Solution, Strong SCHEMBL28822534 | 0.69 | — | — | |
| SCHEMBL29475106 | 0.69 | — | — | |
| SCHEMBL714070 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114790187-B | Preparation method and application of oxacycloalkane | 河北凯瑞化工有限公司 | 2024-03-05 | — | — | CN | claimed |
| CN-114790187-B | Preparation method and application of oxacycloalkane | 河北凯瑞化工有限公司 | 2024-03-05 | — | — | CN | disclosed |
| CN-114790187-B | Preparation method and application of oxacycloalkane | 河北凯瑞化工有限公司 | 2024-03-05 | — | — | CN | disclosed |
| CN-114790187-A | Preparation method and application of oxacycloalkane | 河北凯瑞化工有限公司 | 2022-07-26 | — | — | CN | disclosed |
| US-10167262-B2 | Herbicidal substituted 3-arylpyrazoles | FMC CORPORATION (US) | 2019-01-01 | — | — | US | disclosed |
| US-20170183312-A1 | HERBICIDAL SUBSTITUTED 3-ARYLPYRAZOLES | FMC CORPORATION | 2017-06-29 | — | — | US | disclosed |
| WO-2015191377-A1 | HERBICIDAL SUBSTITUTED 3-ARYLPYRAZOLES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2015-12-17 | — | — | WO | disclosed |