⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27816735 | 0.97 | — | — | |
| SCHEMBL8176590 | 0.75 | — | — | |
| SCHEMBL502813 | 0.75 | — | — | |
| SCHEMBL9333183 | 0.73 | — | — | |
| SCHEMBL8534611 | 0.73 | — | — | |
| SCHEMBL22268 | 0.73 | — | — | |
| SCHEMBL4557350 | 0.73 | — | — | |
| SCHEMBL5519959 | 0.73 | — | — | |
| SCHEMBL1657231 | 0.73 | — | — | |
| SCHEMBL269857 | 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 |
|---|---|---|---|---|---|---|---|
| CN-115697058-A | Agrochemical adjuvants | 禾大国际股份公开有限公司 | 2023-02-03 | — | — | CN | disclosed |
| CN-106211748-A | Agrochemical oil-based concentrates | 禾大国际股份公开有限公司 | 2016-12-07 | — | — | CN | disclosed |