⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1922095 | 0.79 | — | — | |
| SCHEMBL28619871 | 0.75 | — | — | |
| SCHEMBL8403702 | 0.70 | — | — | |
| SCHEMBL8083360 | 0.70 | — | — | |
| SCHEMBL1921066 | 0.70 | LMNA (0.36) | — | |
| SCHEMBL13351801 | 0.70 | GSR (0.46) | — | |
| SCHEMBL6734023 | 0.69 | OPRM1 (0.41) | — | |
| SCHEMBL11479478 | 0.69 | — | — | |
| SCHEMBL1568160 | 0.67 | — | — | |
| SCHEMBL5007154 | 0.67 | — | — |
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-0936906-B1 | REFLUX INHIBITORS | ASTRAZENECA AB (SE) | 2003-09-10 | — | — | EP | claimed |