⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL284681 | 0.82 | — | — | |
| SCHEMBL16672175 | 0.82 | — | — | |
| SCHEMBL14905942 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL10804922 | 0.78 | KDM4E (0.53) | — | |
| SCHEMBL7241239 | 0.77 | — | — | |
| SCHEMBL23791605 | 0.72 | — | — | |
| SCHEMBL4245159 | 0.72 | — | — | |
| SCHEMBL18487774 | 0.70 | — | — | |
| Water SCHEMBL450073 | 0.69 | — | — | |
| SCHEMBL8002040 | 0.69 | — | — |
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-6916481-B1 | Active-substance vector multiparticulate system, production and use thereof | Chimie, Rhodia (FR) | 2005-07-12 | — | — | US | disclosed |