⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15025 | 0.94 | CYP2C9 (0.32) | — | |
| SCHEMBL1899110 | 0.92 | CYP2C9 (0.31) | — | |
| SCHEMBL28242935 | 0.92 | CYP2C9 (0.31) | — | |
| Bromide SCHEMBL28432046 | 0.92 | CYP2C9 (0.31) | — | |
| Ammonia Solution, Strong SCHEMBL15633005 | 0.92 | CYP2C9 (0.31) | — | |
| SCHEMBL1896553 | 0.92 | CYP2C9 (0.31) | — | |
| Hydrochloric Acid SCHEMBL28917497 | 0.92 | CYP2C9 (0.31) | — | |
| SCHEMBL9720257 | 0.89 | CYP2C9 (0.33) | — | |
| SCHEMBL6737631 | 0.84 | CYP2C9 (0.42) | — | |
| Acetic Acid SCHEMBL10681599 | 0.84 | GABRR1 (0.34) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7510731-B2 | Water-soluble stabilized self-assembled polyelectrolytes | LABOPHARM INC. (CA) | 2009-03-31 | — | — | US | disclosed |
| US-20070110709-A1 | Water-soluble stabilized self-assembled polyelectrolytes | ENDO GLOBAL VENTURES (BM) | 2007-05-17 | — | — | US | disclosed |
| EP-1465665-B1 | WATER-SOLUBLE STABILIZED SELF-ASSEMBLED POLYELECTROLYTES | LABOPHARM INC (CA) | 2005-12-21 | — | — | EP | disclosed |
| US-20050244501-A1 | Water-soluble stabilized self-assembled polyelectrolytes | LABOPHARM INC. (CA) | 2005-11-03 | — | — | US | disclosed |
| US-6939564-B2 | Water-soluble stabilized self-assembled polyelectrolytes | LABOPHARM, INC. (CA) | 2005-09-06 | — | — | US | disclosed |
| EP-1465665-A1 | WATER-SOLUBLE STABILIZED SELF-ASSEMBLED POLYELECTROLYTES | LABOPHARM INC. (CA) | 2004-10-13 | — | — | EP | disclosed |
| US-20030059398-A1 | Water-soluble stabilized self-assembled polyelectrolytes | ENDO GLOBAL VENTURES (BM) | 2003-03-27 | — | — | US | disclosed |
| WO-2002100439-A1 | WATER-SOLUBLE STABILIZED SELF-ASSEMBLED POLYELECTROLYTES | LABOPHARM, INC. (CA) | 2002-12-19 | — | — | WO | disclosed |