⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6141459 | 0.82 | — | — | |
| SCHEMBL9011610 | 0.77 | CES2 (0.46) | — | |
| SCHEMBL2759589 | 0.77 | CES2 (0.39) | — | |
| SCHEMBL2104397 | 0.76 | — | — | |
| SCHEMBL18791047 | 0.75 | CES2 (0.50) | — | |
| SCHEMBL509212 | 0.75 | CES2 (0.50) | — | |
| SCHEMBL18791044 | 0.75 | CES2 (0.50) | — | |
| SCHEMBL8595527 | 0.73 | LMNA (0.43) | — | |
| SCHEMBL8595532 | 0.73 | LMNA (0.43) | — | |
| SCHEMBL18988346 | 0.71 | EPHX2 (0.32) | — |
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-1819667-B1 | SULFONAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS | VIROBAY INC (US) | 2012-10-17 | — | — | EP | disclosed |
| US-8163735-B2 | Sulfonamide compounds as cysteine protease inhibitors | VIROBAY, INC. (US) | 2012-04-24 | — | — | US | disclosed |
| US-20090233909-A1 | Sulfonamide compounds as cysteine protease inhibitors | VIROBAY, INC. (US) | 2009-09-17 | — | — | US | disclosed |