⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL55246 | 0.58 | — | — | |
| SCHEMBL345819 | 0.55 | — | — | |
| SCHEMBL3255100 | 0.50 | — | — | |
| SCHEMBL4542266 | 0.50 | — | — | |
| SCHEMBL5683108 | 0.50 | — | — | |
| SCHEMBL838578 | 0.50 | — | — | |
| SCHEMBL65791 | 0.50 | — | — | |
| SCHEMBL10734809 | 0.50 | — | — | |
| SCHEMBL305169 | 0.47 | — | — | |
| SCHEMBL623710 | 0.47 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1061076-B1 | N-ACYL CYCLIC AMINE DERIVATIVES | BANYU PHARMA CO LTD (JP) | 2004-12-08 | — | — | EP | disclosed |
| EP-1061076-A1 | N-ACYL CYCLIC AMINE DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2000-12-20 | — | — | EP | disclosed |