⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL811289 | 0.78 | — | — | |
| SCHEMBL8888941 | 0.78 | — | — | |
| SCHEMBL9416052 | 0.75 | — | — | |
| SCHEMBL2483976 | 0.74 | — | — | |
| SCHEMBL10583445 | 0.73 | — | — | |
| SCHEMBL578549 | 0.73 | — | — | |
| SCHEMBL10877285 | 0.72 | — | — | |
| SCHEMBL27375483 | 0.72 | — | — | |
| SCHEMBL1810313 | 0.72 | — | — | |
| SCHEMBL21828723 | 0.70 | — | — |
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-0588105-A1 | Derivatives of Phosphoryloxypyrazole | BAYER AG (DE) | 1994-03-23 | — | — | EP | claimed |
| EP-0588105-A1 | Derivatives of Phosphoryloxypyrazole | BAYER AG (DE) | 1994-03-23 | — | — | EP | disclosed |