⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24199527 | 0.89 | — | — | |
| SCHEMBL23678259 | 0.86 | — | — | |
| SCHEMBL24199515 | 0.84 | — | — | |
| SCHEMBL24199467 | 0.83 | — | — | |
| SCHEMBL16609549 | 0.83 | SIRT1 (0.31) | — | |
| SCHEMBL24199513 | 0.82 | — | — | |
| SCHEMBL15359565 | 0.81 | NPBWR1 (0.30) | — | |
| SCHEMBL17191049 | 0.80 | CYP1A2 (0.31) | — | |
| SCHEMBL17191063 | 0.80 | GAA (0.33) | — | |
| SCHEMBL23678250 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11225470-B2 | Tetrazolinone compounds and its use as pest control agents | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2022-01-18 | — | — | US | disclosed |