⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL25396181 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL503785 | 0.79 | LMNA (0.39) | — | |
| Hydrochloric Acid SCHEMBL503687 | 0.79 | LMNA (0.32) | — | |
| SCHEMBL537082 | 0.78 | LMNA (0.30) | — | |
| Iodide SCHEMBL3733349 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL503459 | 0.77 | — | — | |
| SCHEMBL25393903 | 0.77 | — | — | |
| SCHEMBL1931519 | 0.76 | TSHR (0.33) | — | |
| SCHEMBL29387859 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL3803544 | 0.75 | TSHR (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120157579-A1 | Azolium Ionomer Derivatives of Halogenated Polymers | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2012-06-21 | — | — | US | claimed |
| WO-2012075574-A1 | AZOLIUM IONOMER DERIVATIVES OF HALOGENATED POLYMERS | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2012-06-14 | — | — | WO | claimed |
| US-20120157579-A1 | Azolium Ionomer Derivatives of Halogenated Polymers | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2012-06-21 | — | — | US | disclosed |
| WO-2012075574-A1 | AZOLIUM IONOMER DERIVATIVES OF HALOGENATED POLYMERS | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2012-06-14 | — | — | WO | disclosed |