⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19755918 | 1.00 | — | — | |
| SCHEMBL17895956 | 0.88 | POLB (0.35) | — | |
| SCHEMBL19755914 | 0.88 | — | — | |
| SCHEMBL25886522 | 0.85 | — | — | |
| SCHEMBL30989648 | 0.85 | — | — | |
| SCHEMBL30958306 | 0.85 | PTGS2 (0.33) | — | |
| SCHEMBL17422452 | 0.85 | PTGS2 (0.33) | — | |
| SCHEMBL22189307 | 0.84 | — | — | |
| SCHEMBL17901879 | 0.83 | — | — | |
| SCHEMBL18179638 | 0.82 | — | — |
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-118745174-A | Pesticidally active heterocyclic derivatives with sulfur containing substituents | 先正达参股股份有限公司 | 2024-10-08 | — | — | CN | disclosed |
| CN-111836810-B | Pesticidally active heterocyclic derivatives with sulfur containing substituents | 先正达参股股份有限公司 | 2024-06-25 | — | — | CN | disclosed |