⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL148461 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL28910571 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL17983284 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL8310942 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL6665559 | 0.87 | EPHX1 (0.50) | — | |
| SCHEMBL331659 | 0.86 | — | — | |
| SCHEMBL26367204 | 0.84 | CYP2C19 (0.53) | — | |
| SCHEMBL3024820 | 0.84 | CYP2C19 (0.53) | — | |
| SCHEMBL7518935 | 0.82 | EPHX1 (0.73) | — | |
| SCHEMBL8821784 | 0.82 | EPHX1 (0.62) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230400395-A1 | PREPARATION OF LIPID NANOPARTICLE ENCAPSULATED NUCLEIC ACID SAMPLES FOR ACCURATE COMPOSITIONAL ANALYSIS | WATERS TECHNOLOGIES CORPORATION (US) | 2023-12-14 | — | — | US | disclosed |