⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23132260 | 0.88 | — | — | |
| SCHEMBL7825299 | 0.85 | CHRM2 (0.35) | — | |
| SCHEMBL3073249 | 0.83 | — | — | |
| SCHEMBL12918801 | 0.83 | — | — | |
| SCHEMBL21841397 | 0.81 | — | — | |
| SCHEMBL16878223 | 0.81 | CHRM2 (0.32) | — | |
| SCHEMBL18885585 | 0.78 | CHRM2 (0.33) | — | |
| SCHEMBL7268795 | 0.78 | — | — | |
| SCHEMBL16689090 | 0.77 | — | — | |
| SCHEMBL21841398 | 0.77 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0377139-B1 | N-substituted acylamino acid compounds, process for their production and their use | BANYU PHARMA CO LTD (JP) | 1995-07-12 | — | — | EP | disclosed |
| US-5424309-A | Hypotensive agents | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1995-06-13 | — | — | US | disclosed |
| EP-0377139-A1 | N-substituted acylamino acid compounds, process for their production and their use | Banyu Pharmaceutical Co., Ltd. (JP) | 1990-07-11 | — | — | EP | disclosed |