⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL38952 | 0.88 | TDP1 (0.36) | — | |
| SCHEMBL4898211 | 0.88 | TDP1 (0.36) | — | |
| SCHEMBL27844036 | 0.87 | — | — | |
| SCHEMBL9857318 | 0.86 | LMNA (0.44) | — | |
| SCHEMBL9856760 | 0.84 | PPOX (0.36) | — | |
| Pyraflufen-Ethyl SCHEMBL53390 | 0.84 | PPOX (0.44) | — | |
| SCHEMBL9857280 | 0.84 | TSHR (0.35) | — | |
| Pyraflufen-Ethyl SCHEMBL29480904 | 0.84 | PPOX (0.44) | — | |
| SCHEMBL15229262 | 0.83 | LMNA (0.31) | — | |
| SCHEMBL15229264 | 0.83 | LMNA (0.31) | — |
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-2004072065-A1 | NOVEL OXYGEN CONTAINING FUSED CYCLIC DERIVATIVES AND HERBIDICAL, DESICCANT AND DEFOLIATE COMPOSITIONS CONTAINING THEM | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2004-08-26 | — | — | WO | disclosed |