⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6292801 | 0.77 | NOTUM (0.38) | — | |
| SCHEMBL6289389 | 0.75 | DHFR (0.30) | — | |
| SCHEMBL6701379 | 0.75 | NSD2 (0.33) | — | |
| SCHEMBL6289380 | 0.66 | SIGMAR1 (0.32) | — | |
| SCHEMBL6292192 | 0.63 | NR4A2 (0.39) | — | |
| SCHEMBL6703304 | 0.63 | — | — | |
| SCHEMBL2590581 | 0.59 | KCNH2 (0.42) | — | |
| SCHEMBL27952974 | 0.58 | LMNA (0.41) | — | |
| SCHEMBL3888886 | 0.56 | CALM1 (0.50) | — | |
| SCHEMBL11272511 | 0.56 | RAB9A (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6949651-B2 | Fused bicyclic metalloproteinase inhibitors | WARNER-LAMBERT COMPANY (US) | 2005-09-27 | — | — | US | disclosed |
| US-20040034054-A1 | Fused bicyclic metalloproteinase inhibitors | LINCOLN FOODSERVICE PRODUCTS INC. | 2004-02-19 | — | — | US | disclosed |
| WO-2004014375-A2 | FUSED BICYCLIC METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |