⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13792960 | 1.00 | — | — | |
| SCHEMBL1074428 | 1.00 | — | — | |
| SCHEMBL681879 | 0.76 | — | — | |
| SCHEMBL767441 | 0.76 | — | — | |
| SCHEMBL3983475 | 0.76 | — | — | |
| SCHEMBL910892 | 0.74 | — | — | |
| SCHEMBL13766089 | 0.74 | — | — | |
| SCHEMBL3987017 | 0.72 | — | — | |
| SCHEMBL3987018 | 0.72 | — | — | |
| SCHEMBL14865494 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1537066-B1 | CYCLOPENTENONE DERIVATIVES AS POTENT ACTIVATORS OF HSF-1 | BIOGEM S C AR L (IT) | 2017-01-25 | — | — | EP | disclosed |
| US-7666619-B2 | Compounds and methods for regulating bacterial growth and pathogenesis | PRINCETON UNIVERSITY (US) | 2010-02-23 | — | — | US | disclosed |
| US-7304186-B2 | Synthetic method and novel chemical compounds | CHARTERHOUSE THERAPEUTICS LTD. (GB) | 2007-12-04 | — | — | US | disclosed |
| WO-2007082026-A2 | CATALYTIC ENANTIOSELECTIVE SILYLATIONS OF SUBSTRATES | THE TRUSTEES OF BOSTON COLLEGE (US) | 2007-07-19 | — | — | WO | disclosed |