⚠ 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL5134367 | 0.78 | HDAC8 (0.30) | — | |
| SCHEMBL1753864 | 0.78 | — | — | |
| SCHEMBL2454572 | 0.74 | — | — | |
| Phosphoric Acid SCHEMBL31207163 | 0.73 | — | — | |
| SCHEMBL2451613 | 0.71 | — | — | |
| SCHEMBL3470871 | 0.70 | — | — | |
| SCHEMBL6522869 | 0.70 | — | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL15656646 | 0.69 | — | — | |
| SCHEMBL2453415 | 0.68 | LAP3 (0.35) | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL4537990 | 0.66 | — | — |
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 |