⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17948691 | 0.69 | — | — | |
| SCHEMBL4266345 | 0.65 | — | — | |
| SCHEMBL31313840 | 0.65 | — | — | |
| SCHEMBL96153 | 0.58 | — | — | |
| SCHEMBL96591 | 0.54 | — | — | |
| SCHEMBL19286055 | 0.52 | — | — | |
| SCHEMBL25008215 | 0.42 | — | — | |
| SCHEMBL23988524 | 0.37 | — | — | |
| SCHEMBL5944923 | 0.34 | TSHR (1.00) | — | |
| SCHEMBL7813261 | 0.28 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140288077-A1 | SUBSTITUTED 4-PHENOXYPHENOL ANALOGS AS MODULATORS OF PROLIFERATING CELL NUCLEAR ANTIGEN ACTIVITY | ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) | 2014-09-25 | — | — | US | disclosed |