⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28337640 | 0.82 | — | — | |
| SCHEMBL29632536 | 0.76 | — | — | |
| SCHEMBL27937662 | 0.73 | — | — | |
| SCHEMBL29024602 | 0.72 | — | — | |
| SCHEMBL22219618 | 0.72 | — | — | |
| SCHEMBL28181919 | 0.72 | — | — | |
| SCHEMBL4023148 | 0.72 | — | — | |
| SCHEMBL120662 | 0.70 | — | — | |
| SCHEMBL28550944 | 0.69 | PKM (0.31) | — | |
| SCHEMBL1317314 | 0.68 | — | — |
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-117412961-A | Pesticidally active heteroaromatic compounds | 先正达农作物保护股份公司 | 2024-01-16 | — | — | CN | disclosed |