⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL111581 | 0.78 | — | — | |
| SCHEMBL1799922 | 0.78 | — | — | |
| SCHEMBL14562305 | 0.75 | — | — | |
| Methane SCHEMBL15355545 | 0.74 | — | — | |
| SCHEMBL6656338 | 0.72 | — | — | |
| SCHEMBL30194875 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL2422200 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL11807164 | 0.67 | — | — | |
| SCHEMBL8764888 | 0.67 | — | — | |
| SCHEMBL4020147 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008129129-A1 | HETEROCYCLIC PHENYL CARBAMATES AS NOVEL FAAH-INHIBITORS | KUOPION YLIOPISTO (FI) | 2008-10-30 | — | — | WO | disclosed |
| WO-2000021936-A1 | URACIL HERBICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-04-20 | — | — | WO | disclosed |