⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2829254 | 0.68 | — | — | |
| SCHEMBL213131 | 0.66 | MAPT (0.38) | — | |
| SCHEMBL9296811 | 0.65 | — | — | |
| SCHEMBL4158293 | 0.64 | — | — | |
| SCHEMBL5571254 | 0.63 | — | — | |
| SCHEMBL18685897 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL25650770 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL5530226 | 0.62 | MAPT (0.31) | — | |
| SCHEMBL1621071 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL10623512 | 0.62 | — | — |
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-1835900-A1 | SULFASALAZINE ANALOGUES AS NF-KB INHIBITORS | UNIVERSITY OF SOUTHAMPTON (GB) | 2007-09-26 | — | — | EP | disclosed |
| WO-2006072783-A1 | SULFASALAZINE ANALOGUES AS NF-KB INHIBITORS | UNIVERSITY OF SOUTHAMPTON (GB) | 2006-07-13 | — | — | WO | disclosed |