⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2640244 | 0.91 | CPB2 (0.36) | — | |
| SCHEMBL8943205 | 0.91 | CPB2 (0.36) | — | |
| SCHEMBL7375737 | 0.90 | ALOX5 (0.34) | — | |
| SCHEMBL7375837 | 0.90 | — | — | |
| SCHEMBL5665177 | 0.89 | ANPEP (0.34) | — | |
| SCHEMBL8190656 | 0.89 | ANPEP (0.34) | — | |
| SCHEMBL1449256 | 0.88 | METAP1 (0.37) | — | |
| SCHEMBL7418539 | 0.88 | METAP1 (0.37) | — | |
| SCHEMBL3504941 | 0.88 | METAP1 (0.37) | — | |
| SCHEMBL10583766 | 0.84 | CPN1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20020065230-A1 | Protease inhibitors | SMITHKLINE BEECHAM CORPORATION | 2002-05-30 | — | — | US | claimed |
| CN-1255119-A | Protease inhibitors | SMITHKLINE BEECHAM CORP (US) | 2000-05-31 | — | — | CN | claimed |
| US-20020065230-A1 | Protease inhibitors | SMITHKLINE BEECHAM CORPORATION | 2002-05-30 | — | — | US | disclosed |