⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6631345 | 1.00 | — | — | |
| SCHEMBL5211646 | 0.83 | RAB9A (0.33) | — | |
| SCHEMBL6619541 | 0.83 | RAB9A (0.33) | — | |
| SCHEMBL4156095 | 0.82 | — | — | |
| SCHEMBL5211803 | 0.82 | GRM1 (0.30) | — | |
| SCHEMBL5213331 | 0.82 | LMNA (0.32) | — | |
| SCHEMBL5212107 | 0.81 | KDM4E (0.37) | — | |
| SCHEMBL5641473 | 0.81 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL5218240 | 0.81 | — | — | |
| SCHEMBL5215885 | 0.81 | ADORA2B (0.33) | — |
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-7259163-B2 | 4-(6-membered)-heteroaryl acyl pyrrolidine derivatives as HCV inhibitors | GLAXO GROUP LIMITED (GB) | 2007-08-21 | — | — | US | disclosed |
| EP-1440069-B1 | 4-(6-MEMBERED)-HETEROARYL ACYL PYRROLIDINE DERIVATIVES AS HCV INHIBITORS | GLAXO GROUP LTD (GB) | 2007-08-15 | — | — | EP | disclosed |
| US-20050043390-A1 | 4-(6-membered)-heteroaryl acyl pyrrolidine derivatives as hcv inhibitors | GLAXO GROUP LIMITED (GB) | 2005-02-24 | — | — | US | disclosed |