⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9521586 | 0.82 | CYP3A4 (0.36) | — | |
| SCHEMBL9867861 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL9866855 | 0.78 | ALDH1A1 (0.30) | — | |
| SCHEMBL9868309 | 0.74 | KDM4E (0.47) | — | |
| SCHEMBL9522954 | 0.74 | — | — | |
| SCHEMBL9519978 | 0.72 | NOTUM (0.36) | — | |
| SCHEMBL9519955 | 0.63 | POLB (0.43) | — | |
| SCHEMBL11400671 | 0.56 | LMNA (0.39) | — | |
| SCHEMBL1086035 | 0.51 | L3MBTL1 (0.41) | — | |
| SCHEMBL1928130 | 0.51 | GPR35 (0.36) | — |
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-0300898-B1 | PYRETHRINOID DERIVATIVES CONTAINING AN N-HETEROCYCLE, PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS PESTICIDES AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1993-03-10 | — | — | EP | disclosed |