⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6156716 | 0.83 | — | — | |
| SCHEMBL6156722 | 0.83 | — | — | |
| SCHEMBL3908467 | 0.78 | — | — | |
| SCHEMBL960587 | 0.76 | — | — | |
| SCHEMBL960586 | 0.76 | — | — | |
| SCHEMBL27312462 | 0.76 | — | — | |
| SCHEMBL4595526 | 0.75 | TSHR (0.40) | — | |
| SCHEMBL4595528 | 0.75 | TSHR (0.40) | — | |
| SCHEMBL7173624 | 0.75 | — | — | |
| SCHEMBL9856455 | 0.75 | — | — |
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-108713016-B | Pesticidally active pyrazole derivatives | 先正达参股股份有限公司 | 2021-10-08 | — | — | CN | disclosed |