⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24361078 | 0.92 | — | — | |
| SCHEMBL24360721 | 0.85 | UGT8 (0.32) | — | |
| SCHEMBL24360760 | 0.84 | — | — | |
| SCHEMBL24360717 | 0.83 | KDM4E (0.30) | — | |
| SCHEMBL24360733 | 0.83 | — | — | |
| SCHEMBL24361081 | 0.83 | — | — | |
| SCHEMBL20547475 | 0.82 | — | — | |
| SCHEMBL18179828 | 0.82 | — | — | |
| SCHEMBL24361308 | 0.81 | — | — | |
| SCHEMBL20547491 | 0.81 | KCNH2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3615540-B1 | CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES | BAYER AG (DE) | 2022-04-27 | — | — | EP | disclosed |