⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18546293 | 0.79 | HCAR1 (0.42) | — | |
| SCHEMBL26714095 | 0.73 | HTR7 (0.36) | — | |
| SCHEMBL16425569 | 0.72 | OPRM1 (0.42) | — | |
| SCHEMBL15352598 | 0.70 | JAK2 (0.43) | — | |
| SCHEMBL15337636 | 0.69 | HSD17B10 (0.47) | — | |
| SCHEMBL18546250 | 0.68 | GABRA1 (0.47) | — | |
| SCHEMBL9052646 | 0.67 | GSK3A (0.46) | — | |
| SCHEMBL16414529 | 0.67 | HCAR1 (0.42) | — | |
| SCHEMBL15352088 | 0.67 | HTR7 (0.39) | — | |
| SCHEMBL26714087 | 0.67 | ESR1 (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 |
|---|---|---|---|---|---|---|---|
| WO-2025040900-A2 | FUNGICIDAL COMPOUNDS | REDAG CROP PROTECTION LTD (GB) | 2025-02-27 | — | — | WO | disclosed |