⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25390288 | 0.84 | — | — | |
| SCHEMBL7680327 | 0.74 | — | — | |
| SCHEMBL7680321 | 0.74 | — | — | |
| SCHEMBL25386894 | 0.71 | HIF1A (0.32) | — | |
| SCHEMBL7093146 | 0.60 | — | — | |
| SCHEMBL6445870 | 0.59 | LMNA (0.43) | — | |
| SCHEMBL27345540 | 0.59 | FOLH1 (0.57) | — | |
| SCHEMBL3145510 | 0.58 | ALDH1A1 (0.42) | — | |
| SCHEMBL152624 | 0.57 | ALDH1A1 (0.50) | — | |
| SCHEMBL8746153 | 0.57 | ALDH1A1 (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-4242199-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 XII | BASF SE (DE) | 2023-09-13 | — | — | EP | disclosed |