⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL251268 | 0.96 | — | — | |
| SCHEMBL27598619 | 0.93 | — | — | |
| SCHEMBL1719840 | 0.93 | — | — | |
| SCHEMBL3854312 | 0.93 | — | — | |
| SCHEMBL553456 | 0.93 | — | — | |
| SCHEMBL2315815 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL11581409 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL4024833 | 0.90 | — | — | |
| SCHEMBL5534423 | 0.90 | — | — | |
| Bromide SCHEMBL5862208 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7709635-B2 | Boronium-ion-based ionic liquids and methods of use thereof | UNIVERSITY OF SOUTH ALABAMA (US) | 2010-05-04 | — | — | US | disclosed |
| US-20060287521-A1 | Boronium-ion-based ionic liquids and methods of use thereof | UNIVERSITY OF SOUTH ALABAMA (US) | 2006-12-21 | — | — | US | disclosed |
| WO-2006125175-A2 | BORONIUM-ION-BASED IONIC LIQUIDS AND METHODS OF USE THEREOF | UNIVERSITY OF SOUTH ALABAMA (US) | 2006-11-23 | — | — | WO | disclosed |