⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6363648 | 0.77 | — | — | |
| SCHEMBL2642950 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL27756683 | 0.73 | NOS3 (0.37) | — | |
| SCHEMBL17121624 | 0.73 | — | — | |
| SCHEMBL5685885 | 0.70 | GAA (0.33) | — | |
| SCHEMBL2643086 | 0.70 | — | — | |
| SCHEMBL2443190 | 0.68 | — | — | |
| SCHEMBL2443188 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL2760854 | 0.68 | MAPT (0.35) | — | |
| SCHEMBL2642564 | 0.65 | — | — |
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-0007633-B1 | CEPHEM COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1984-04-18 | — | — | EP | disclosed |