⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL104481 | 0.96 | — | — | |
| Iodide SCHEMBL27846717 | 0.93 | — | — | |
| SCHEMBL15855949 | 0.93 | HIF1A (0.43) | — | |
| Water SCHEMBL27467421 | 0.93 | — | — | |
| Bromide SCHEMBL4189519 | 0.93 | — | — | |
| SCHEMBL14157886 | 0.93 | HIF1A (0.33) | — | |
| SCHEMBL2035218 | 0.93 | HIF1A (0.43) | — | |
| Hydrochloric Acid SCHEMBL19547768 | 0.93 | — | — | |
| Hydrazine SCHEMBL8005298 | 0.93 | — | — | |
| Fluoride SCHEMBL27859430 | 0.93 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-118490648-A | Piperacillin sodium tazobactam sodium for injection and preparation method thereof | 成都晶富医药科技有限公司 | 2024-08-16 | — | — | CN | disclosed |