⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6324570 | 0.76 | CYP1A2 (0.31) | — | |
| SCHEMBL6319853 | 0.70 | — | — | |
| SCHEMBL6325825 | 0.63 | — | — | |
| SCHEMBL6317930 | 0.58 | — | — | |
| SCHEMBL4766858 | 0.56 | CAPN1 (0.40) | — | |
| SCHEMBL542826 | 0.56 | — | — | |
| SCHEMBL13953041 | 0.55 | — | — | |
| Water SCHEMBL28791280 | 0.54 | GLA (0.34) | — | |
| Methane SCHEMBL28186517 | 0.54 | GLA (0.34) | — | |
| Iodide SCHEMBL633579 | 0.54 | GLA (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050143349-A1 | Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels | QUATRX PHARMACEUTICALS CO. | 2005-06-30 | — | — | US | claimed |
| US-20050143349-A1 | Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels | QUATRX PHARMACEUTICALS CO. | 2005-06-30 | — | — | US | disclosed |