⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL173393 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL366035 | 0.83 | — | — | |
| Bromide SCHEMBL2214552 | 0.83 | — | — | |
| Iodide SCHEMBL380493 | 0.83 | — | — | |
| SCHEMBL2451613 | 0.82 | — | — | |
| Acetic Acid SCHEMBL457851 | 0.81 | — | — | |
| Nitric Acid SCHEMBL2780178 | 0.79 | — | — | |
| SCHEMBL2213159 | 0.78 | — | — | |
| SCHEMBL2514637 | 0.78 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL4681718 | 0.76 | KCNH2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2547822-A1 | PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE | University Of Helsinki (FI) | 2013-01-23 | — | — | EP | disclosed |
| WO-2011114004-A1 | PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE | UNIVERSITY OF HELSINKI (FI) | 2011-09-22 | — | — | WO | disclosed |