⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4267778 | 0.73 | — | — | |
| SCHEMBL8194397 | 0.70 | — | — | |
| SCHEMBL4685614 | 0.68 | — | — | |
| SCHEMBL14237001 | 0.67 | LMNA (0.48) | — | |
| SCHEMBL4053225 | 0.63 | — | — | |
| SCHEMBL8315390 | 0.63 | ALDH1A1 (0.43) | — | |
| SCHEMBL6139412 | 0.62 | ADRA1A (0.32) | — | |
| SCHEMBL346079 | 0.62 | — | — | |
| SCHEMBL5526822 | 0.61 | GABRA1 (0.40) | — | |
| SCHEMBL2494282 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1476423-A4 | ARYLSULFONAMIDOBENZYLIC COMPOUNDS | TULARIK INC (US) | 2005-12-14 | — | — | EP | disclosed |
| EP-1476423-A2 | ARYLSULFONAMIDOBENZYLIC COMPOUNDS | Tularik Inc. (US) | 2004-11-17 | — | — | EP | disclosed |
| WO-2003063576-A2 | ARYLSULFONAMIDOBENZYLIC COMPOUNDS | TULARIK INC. (US) | 2003-08-07 | — | — | WO | disclosed |