⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23965704 | 0.91 | — | — | |
| SCHEMBL23965695 | 0.86 | HIF1A (0.33) | — | |
| SCHEMBL23971763 | 0.84 | HIF1A (0.39) | — | |
| SCHEMBL23965592 | 0.84 | — | — | |
| SCHEMBL23965641 | 0.82 | — | — | |
| SCHEMBL23965636 | 0.82 | GAA (0.34) | — | |
| SCHEMBL23978207 | 0.81 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL23971781 | 0.79 | HIF1A (0.31) | — | |
| SCHEMBL23978133 | 0.79 | HPGD (0.39) | — | |
| SCHEMBL23965635 | 0.79 | KDM4E (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 |
|---|---|---|---|---|---|---|---|
| EP-3903581-A1 | USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS I | BASF SE (DE) | 2021-11-03 | — | — | EP | disclosed |