⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26150447 | 0.75 | LMNA (0.33) | — | |
| SCHEMBL24708771 | 0.70 | LMNA (0.34) | — | |
| SCHEMBL25921070 | 0.68 | EPHX1 (0.44) | — | |
| SCHEMBL22623220 | 0.67 | EPHX1 (0.34) | — | |
| SCHEMBL22295960 | 0.65 | EPHX1 (0.52) | — | |
| SCHEMBL5204225 | 0.65 | — | — | |
| SCHEMBL19983262 | 0.65 | — | — | |
| SCHEMBL14724285 | 0.64 | EPHX1 (0.33) | — | |
| SCHEMBL25921054 | 0.64 | FAAH (0.43) | — | |
| SCHEMBL25969203 | 0.64 | EPHX1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018071327-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2018-04-19 | — | — | WO | disclosed |