⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7716709 | 0.71 | — | — | |
| SCHEMBL6902874 | 0.68 | — | — | |
| SCHEMBL8159192 | 0.67 | — | — | |
| SCHEMBL5452732 | 0.67 | TSHR (0.36) | — | |
| SCHEMBL1784686 | 0.67 | — | — | |
| SCHEMBL1780920 | 0.65 | — | — | |
| SCHEMBL25171555 | 0.62 | TDP1 (0.32) | — | |
| SCHEMBL1782179 | 0.62 | THRB (0.33) | — | |
| SCHEMBL10615152 | 0.62 | — | — | |
| SCHEMBL5925211 | 0.60 | — | — |
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-0706528-A1 | FUCOSYLATED GLYCOSIDES AS INHIBITORS OF BACTERIAL ADHERENCE | Astra Aktiebolag (SE) | 1996-04-17 | — | — | EP | claimed |