⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12489957 | 0.85 | KDM1A (0.36) | — | |
| SCHEMBL30990293 | 0.85 | KDM1A (0.36) | — | |
| SCHEMBL2556351 | 0.79 | DPP4 (0.38) | — | |
| SCHEMBL30096747 | 0.79 | DPP4 (0.38) | — | |
| SCHEMBL2012031 | 0.78 | ERN1 (0.33) | — | |
| SCHEMBL1421365 | 0.77 | — | — | |
| SCHEMBL15067721 | 0.76 | KDM1A (0.33) | — | |
| SCHEMBL30681287 | 0.75 | PKM (0.39) | — | |
| SCHEMBL1823434 | 0.75 | PTPN1 (0.37) | — | |
| SCHEMBL2235036 | 0.75 | PKM (0.39) | — |
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-2411388-A2 | PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES | Elan Pharmaceuticals Inc. (US) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010111418-A2 | PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES | ELAN PHARMACEUTICALS, INC. (US) | 2010-09-30 | — | — | WO | disclosed |