⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7425055 | 0.80 | TP53 (0.32) | — | |
| SCHEMBL7436742 | 0.75 | APP (0.31) | — | |
| SCHEMBL7435758 | 0.73 | TP53 (0.34) | — | |
| SCHEMBL7432290 | 0.69 | KDM4E (0.36) | — | |
| SCHEMBL7437531 | 0.67 | CA9 (0.40) | — | |
| SCHEMBL7684870 | 0.66 | EDNRA (0.57) | — | |
| SCHEMBL11085866 | 0.66 | APP (0.36) | — | |
| SCHEMBL7428737 | 0.66 | FFAR1 (0.44) | — | |
| Acetic Acid SCHEMBL974711 | 0.65 | APP (0.36) | — | |
| SCHEMBL970932 | 0.65 | APP (0.38) | — |
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-0375451-A2 | Compounds having a renin-inhibiting activity | BEECHAM GROUP PLC (GB) | 1990-06-27 | — | — | EP | disclosed |