⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6751834 | 0.81 | CHRNB2 (0.31) | — | |
| SCHEMBL8316024 | 0.80 | CHRNB2 (0.30) | — | |
| SCHEMBL6749219 | 0.76 | CPN1 (0.33) | — | |
| SCHEMBL7143739 | 0.75 | NR1H2 (0.36) | — | |
| SCHEMBL6749482 | 0.74 | HSD11B1 (0.34) | — | |
| SCHEMBL6749478 | 0.74 | HSD11B1 (0.34) | — | |
| SCHEMBL6745589 | 0.74 | HSD11B1 (0.35) | — | |
| SCHEMBL6749623 | 0.72 | — | — | |
| SCHEMBL6750578 | 0.72 | TPSAB1 (0.34) | — | |
| SCHEMBL6750582 | 0.72 | TPSAB1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20040092737-A1 | Benzopiperidine derivatives | EISAI CO., LTD. | 2004-05-13 | — | — | US | disclosed |