⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL74283 | 0.96 | — | — | |
| SCHEMBL29755539 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL29022548 | 0.92 | — | — | |
| SCHEMBL11297277 | 0.92 | — | — | |
| Hypochlorous Acid SCHEMBL28675275 | 0.88 | — | — | |
| Acrylamide SCHEMBL28063704 | 0.82 | ALDH1A1 (0.73) | — | |
| SCHEMBL28461862 | 0.79 | LMNA (0.44) | — | |
| Acrylic Acid SCHEMBL2481347 | 0.75 | — | — | |
| Acrylic Acid SCHEMBL28595023 | 0.72 | LMNA (0.77) | — | |
| Acrylic Acid SCHEMBL28926860 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150183908-A1 | COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS AND USES THEREOF | VIFOR (INTERNATIONAL) LTD. (CH) | 2015-07-02 | — | — | US | disclosed |
| WO-2014015244-A1 | COMPOSITIONS COMPRISING CROSSLINKED CATION-BINDING POLYMERS | SORBENT THERAPEUTICS, INC. (US) | 2014-01-23 | — | — | WO | disclosed |