⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2629330 | 0.73 | — | — | |
| SCHEMBL2633427 | 0.71 | — | — | |
| SCHEMBL19328287 | 0.70 | ATM (0.36) | — | |
| SCHEMBL17662683 | 0.68 | — | — | |
| SCHEMBL6124223 | 0.68 | — | — | |
| SCHEMBL16848183 | 0.68 | GABRA1 (0.36) | — | |
| SCHEMBL12262831 | 0.68 | — | — | |
| SCHEMBL11198481 | 0.66 | LMNA (0.31) | — | |
| SCHEMBL16848182 | 0.66 | DAGLA (0.34) | — | |
| SCHEMBL19447778 | 0.66 | ACHE (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0378082-B1 | 1-Hydroxy-1,2,4-triazoles | BASF AG (DE) | 1994-06-08 | — | — | EP | disclosed |
| EP-0378082-A1 | 1-Hydroxy-1,2,4-triazoles | BASF Aktiengesellschaft (DE) | 1990-07-18 | — | — | EP | disclosed |