⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL682 | 0.97 | — | — | |
| SCHEMBL8463343 | 0.97 | GAA (0.60) | — | |
| SCHEMBL3258662 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL681 | 0.94 | — | — | |
| SCHEMBL28235834 | 0.94 | — | — | |
| SCHEMBL7868702 | 0.94 | — | — | |
| Bromide SCHEMBL17180527 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL15018344 | 0.94 | — | — | |
| SCHEMBL30405866 | 0.94 | — | — | |
| SCHEMBL27503882 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101535594-B | Polyelectrolyte complexes for oil and gas applications | UNIV KANSAS | 2013-09-18 | — | — | CN | disclosed |
| CN-101535594-A | Polyelectrolyte complexes for oil and gas applications | UNIV KANSAS (US) | 2009-09-16 | — | — | CN | disclosed |