⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20205617 | 0.92 | RAB9A (0.32) | — | |
| SCHEMBL23678154 | 0.87 | TSHR (0.31) | — | |
| SCHEMBL23678408 | 0.87 | — | — | |
| SCHEMBL23678403 | 0.82 | LMNA (0.31) | — | |
| SCHEMBL20205821 | 0.80 | — | — | |
| SCHEMBL20205663 | 0.79 | — | — | |
| SCHEMBL20205486 | 0.79 | GAA (0.34) | — | |
| SCHEMBL20205879 | 0.78 | KMT2A (0.35) | — | |
| SCHEMBL23678317 | 0.78 | — | — | |
| SCHEMBL20205777 | 0.78 | — | — |
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-2018097318-A1 | TETRAZOLINONE COMPOUNDS AND ITS USE AS PEST CONTROL AGENTS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2018-05-31 | — | — | WO | disclosed |