⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22563827 | 0.85 | RXRA (0.32) | — | |
| SCHEMBL22564031 | 0.85 | S1PR1 (0.36) | — | |
| SCHEMBL18504710 | 0.85 | RXRA (0.32) | — | |
| SCHEMBL22563898 | 0.85 | — | — | |
| SCHEMBL22564495 | 0.84 | — | — | |
| SCHEMBL22564079 | 0.84 | HTR2A (0.32) | — | |
| SCHEMBL22564027 | 0.83 | HCRTR1 (0.32) | — | |
| SCHEMBL22564516 | 0.83 | RXRA (0.36) | — | |
| SCHEMBL22564306 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL22564266 | 0.82 | PIEZO1 (0.34) | — |
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-2841429-B1 | TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES | SUMITOMO CHEMICAL CO (JP) | 2020-10-21 | — | — | EP | disclosed |