⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12067537 | 0.77 | — | — | |
| SCHEMBL10128969 | 0.74 | CYP19A1 (0.47) | — | |
| SCHEMBL1485909 | 0.71 | — | — | |
| SCHEMBL13450199 | 0.71 | — | — | |
| SCHEMBL16838899 | 0.71 | — | — | |
| SCHEMBL12992768 | 0.69 | — | — | |
| SCHEMBL22268556 | 0.69 | MAOB (0.38) | — | |
| SCHEMBL5499439 | 0.69 | MAOB (0.38) | — | |
| SCHEMBL12992789 | 0.68 | — | — | |
| SCHEMBL14138306 | 0.68 | TRPA1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7759502-B2 | Useful for inhibiting the aggregation of amyloid protein to form amyloid deposit | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2010-07-20 | — | — | US | disclosed |
| US-20080108840-A1 | Stilbene Derivatives And Their Use For Binding And Imaging Amyloid Plaques | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2008-05-08 | — | — | US | disclosed |