⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24174571 | 1.00 | — | — | |
| SCHEMBL30404915 | 0.86 | NPC1 (0.30) | — | |
| SCHEMBL24174570 | 0.86 | NPC1 (0.30) | — | |
| SCHEMBL24175258 | 0.83 | — | — | |
| SCHEMBL24175437 | 0.83 | — | — | |
| SCHEMBL24175239 | 0.82 | — | — | |
| SCHEMBL24174510 | 0.79 | PDE10A (0.32) | — | |
| SCHEMBL24175632 | 0.76 | — | — | |
| SCHEMBL24174792 | 0.75 | PTGDR2 (0.34) | — | |
| SCHEMBL24174578 | 0.74 | — | — |
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-4175961-A1 | HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS | Bayer Aktiengesellschaft (DE) | 2023-05-10 | — | — | EP | disclosed |