⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22341365 | 1.00 | — | — | |
| SCHEMBL17501013 | 0.73 | CA12 (0.33) | — | |
| SCHEMBL17501200 | 0.73 | CA12 (0.33) | — | |
| SCHEMBL13014866 | 0.71 | — | — | |
| SCHEMBL18800971 | 0.71 | — | — | |
| SCHEMBL7920451 | 0.71 | — | — | |
| SCHEMBL7920688 | 0.71 | — | — | |
| SCHEMBL7350450 | 0.71 | — | — | |
| SCHEMBL2075446 | 0.69 | — | — | |
| SCHEMBL7722754 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1193026-C | Z-pyrazoline-5-ones | BASF AG (DE) | 2005-03-16 | — | — | CN | disclosed |
| CN-1377346-A | Z-pyrazoline-5-ones | BASF AG (DE) | 2002-10-30 | — | — | CN | disclosed |
| EP-0678503-B1 | Delta-amino-gamma-hydroxy-omega-aryl alkanoic acid amides with enzyme especially renin inhibiting activities | NOVARTIS AG (CH) | 1999-09-01 | — | — | EP | disclosed |