⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2455153 | 0.79 | — | — | |
| SCHEMBL8990638 | 0.75 | — | — | |
| SCHEMBL5394659 | 0.65 | — | — | |
| SCHEMBL23600285 | 0.63 | — | — | |
| SCHEMBL798813 | 0.63 | — | — | |
| SCHEMBL8058332 | 0.61 | — | — | |
| SCHEMBL15661694 | 0.60 | — | — | |
| SCHEMBL7951805 | 0.60 | — | — | |
| SCHEMBL1985944 | 0.59 | — | — | |
| SCHEMBL1469626 | 0.58 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110612295-B | Pyrazole-3-carboxylic acid amide derivative and pest control agent | 组合化学工业株式会社 | 2023-07-14 | — | — | CN | disclosed |