⚠ 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 | |
|---|---|---|---|---|
| Hypochlorous Acid SCHEMBL3761791 | 0.83 | — | — | |
| SCHEMBL1127413 | 0.83 | NOS3 (0.32) | — | |
| SCHEMBL3844302 | 0.83 | NOS3 (0.32) | — | |
| Hydrochloric Acid SCHEMBL2807165 | 0.81 | NOS3 (0.31) | — | |
| Hydrochloric Acid SCHEMBL337400 | 0.81 | NOS3 (0.31) | — | |
| Hydrochloric Acid SCHEMBL641826 | 0.81 | NOS3 (0.31) | — | |
| Hydrochloric Acid SCHEMBL337401 | 0.81 | NOS3 (0.31) | — | |
| Hydrochloric Acid SCHEMBL10593578 | 0.81 | NOS3 (0.31) | — | |
| SCHEMBL7689537 | 0.74 | CA1 (0.32) | — | |
| Sulfuric Acid SCHEMBL1670999 | 0.74 | KDM4E (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1046037-B1 | IMPROVED MAGNETIC PARTICLES, METHOD FOR OBTAINING SAME AND USES FOR SEPARATING MOLECULES | BIO MERIEUX (FR) | 2005-05-11 | — | — | EP | claimed |
| US-6521341-B1 | Intermediate layer is present between the internal core and the external layer, which isolates the magnetic filler | BIO MERIEUX (FR) | 2003-02-18 | — | — | US | claimed |
| US-6521341-B1 | Intermediate layer is present between the internal core and the external layer, which isolates the magnetic filler | BIO MERIEUX (FR) | 2003-02-18 | — | — | US | disclosed |