⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9706543 | 0.74 | — | — | |
| SCHEMBL11641864 | 0.72 | — | — | |
| SCHEMBL1943647 | 0.72 | — | — | |
| SCHEMBL11313404 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7679426 | 0.69 | — | — | |
| SCHEMBL133700 | 0.69 | — | — | |
| SCHEMBL4303600 | 0.68 | — | — | |
| SCHEMBL9435758 | 0.68 | — | — | |
| SCHEMBL9116024 | 0.68 | — | — | |
| SCHEMBL3814959 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2468741-A1 | Novel quercetin derivatives, their preparation, pharmaceutical compositions containing them and their use | Bel/Novamann International s.r.o. (SK) | 2012-06-27 | — | — | EP | disclosed |