⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1887000 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL1882729 | 0.81 | — | — | |
| SCHEMBL1889565 | 0.79 | PRKCA (0.34) | — | |
| SCHEMBL1887543 | 0.77 | ALOX15 (0.31) | — | |
| SCHEMBL1884938 | 0.74 | — | — | |
| SCHEMBL681184 | 0.73 | ELANE (0.34) | — | |
| SCHEMBL1880867 | 0.73 | ACHE (0.36) | — | |
| SCHEMBL2949114 | 0.73 | GABBR2 (0.36) | — | |
| SCHEMBL2949112 | 0.71 | — | — | |
| SCHEMBL1891825 | 0.71 | NPC1 (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7935686-B2 | Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use | XENOPORT, INC. (US) | 2011-05-03 | — | — | US | disclosed |
| US-20090124582-A1 | Acyloxyalkyl Carbamate Prodrugs, Methods of Synthesis, and Use | XENOPORT, INC. (US) | 2009-05-14 | — | — | US | disclosed |
| US-7494985-B2 | Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use | XENOPORT, INC. (US) | 2009-02-24 | — | — | US | disclosed |
| US-20060111325-A1 | Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use | XENOPORT, INC. | 2006-05-25 | — | — | US | disclosed |