⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5453073 | 0.90 | — | — | |
| SCHEMBL5466385 | 0.90 | KCNH2 (0.33) | — | |
| SCHEMBL5459809 | 0.85 | KCNH2 (0.38) | — | |
| SCHEMBL5458999 | 0.84 | JAK2 (0.30) | — | |
| SCHEMBL5470818 | 0.84 | JAK2 (0.37) | — | |
| SCHEMBL5462498 | 0.82 | KCNH2 (0.33) | — | |
| SCHEMBL5460115 | 0.80 | KCNH2 (0.33) | — | |
| SCHEMBL5455742 | 0.80 | JAK2 (0.31) | — | |
| SCHEMBL5454105 | 0.80 | KCNH2 (0.34) | — | |
| SCHEMBL5801602 | 0.79 | KCNH2 (0.35) | — |
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-20070191333-A1 | Antibacterial agents | WARNER LAMBERT COMPANY LLC | 2007-08-16 | — | — | US | claimed |
| US-20070191333-A1 | Antibacterial agents | WARNER LAMBERT COMPANY LLC | 2007-08-16 | — | — | US | disclosed |
| US-20070191333-A1 | Antibacterial agents | WARNER LAMBERT COMPANY LLC | 2007-08-16 | — | — | US | disclosed |