⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15290275 | 1.00 | — | — | |
| SCHEMBL17017282 | 0.82 | — | — | |
| SCHEMBL31679616 | 0.82 | — | — | |
| SCHEMBL8635159 | 0.79 | — | — | |
| SCHEMBL30985664 | 0.79 | — | — | |
| SCHEMBL7516610 | 0.76 | — | — | |
| SCHEMBL7516629 | 0.76 | — | — | |
| SCHEMBL7521664 | 0.76 | — | — | |
| SCHEMBL7521659 | 0.76 | — | — | |
| SCHEMBL18092328 | 0.76 | FAAH (0.39) | — |
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-0688336-A1 | PEPTIDE BORONIC ACID DERIVATIVES HAVING PROTEASE INHIBITING ACTIVITY | SANDOZ LTD (CH) | 1995-12-27 | — | — | EP | disclosed |
| WO-1994020526-A1 | PEPTIDE BORONIC ACID DERIVATIVES HAVING PROTEASE INHIBITING ACTIVITY | SANDOZ LTD. (CH) | 1994-09-15 | — | — | WO | disclosed |