⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL867268 | 0.77 | — | — | |
| SCHEMBL219556 | 0.77 | — | — | |
| SCHEMBL9098521 | 0.75 | — | — | |
| SCHEMBL11597967 | 0.70 | — | — | |
| SCHEMBL8893309 | 0.64 | — | — | |
| SCHEMBL6138263 | 0.64 | — | — | |
| SCHEMBL11409220 | 0.64 | — | — | |
| SCHEMBL3927111 | 0.62 | LMNA (0.34) | — | |
| SCHEMBL27633653 | 0.62 | — | — | |
| SCHEMBL218665 | 0.61 | — | — |
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-0055105-A2 | Triazolinones, and their production and use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1982-06-30 | — | — | EP | disclosed |