⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2208193 | 1.00 | — | — | |
| SCHEMBL4600126 | 1.00 | — | — | |
| SCHEMBL2210117 | 0.88 | NPSR1 (0.36) | — | |
| SCHEMBL2211369 | 0.88 | F2 (0.38) | — | |
| SCHEMBL15196130 | 0.88 | F2 (0.38) | — | |
| SCHEMBL2207874 | 0.87 | NPSR1 (0.36) | — | |
| SCHEMBL2206672 | 0.85 | — | — | |
| SCHEMBL14611380 | 0.83 | NPSR1 (0.37) | — | |
| SCHEMBL5499080 | 0.81 | ACE (0.50) | — | |
| SCHEMBL1734898 | 0.80 | DPP4 (0.40) | — |
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-1912662-A2 | PEPTIDE DEFORMYLASE INHIBITORS | SmithKline Beecham Corporation (US) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007016364-A2 | PEPTIDE DEFORMYLASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-02-08 | — | — | WO | disclosed |