⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22700187 | 0.65 | — | — | |
| Bromide SCHEMBL10599199 | 0.56 | — | — | |
| SCHEMBL11891519 | 0.48 | — | — | |
| Hydrochloric Acid SCHEMBL7938304 | 0.46 | — | — | |
| SCHEMBL1468768 | 0.46 | — | — | |
| SCHEMBL7703054 | 0.46 | — | — | |
| SCHEMBL16254630 | 0.46 | — | — | |
| Hydrochloric Acid SCHEMBL7938305 | 0.45 | — | — | |
| SCHEMBL13360255 | 0.41 | — | — | |
| SCHEMBL249133 | 0.41 | — | — |
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-3512860-B1 | NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT | LCB PHARMA INC (CA) | 2020-11-25 | — | — | EP | disclosed |