⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1539079 | 0.50 | — | — | |
| Ammonia Solution, Strong SCHEMBL9388163 | 0.47 | — | — | |
| Hydrogen Peroxide SCHEMBL4116724 | 0.39 | — | — | |
| Hydrogen Peroxide SCHEMBL1735997 | 0.39 | — | — | |
| SCHEMBL5685354 | 0.33 | — | — | |
| SCHEMBL3663754 | 0.33 | — | — | |
| SCHEMBL4597 | 0.33 | — | — | |
| SCHEMBL9442113 | 0.33 | — | — | |
| SCHEMBL15741733 | 0.33 | — | — | |
| SCHEMBL9395787 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2006113457-A1 | POLYMER-FLUOROSURFACTANT ASSOCIATIVE COMPLEXES | THE CLOROX COMPANY (US) | 2006-10-26 | — | — | WO | claimed |
| EP-2402325-B1 | Hydroxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors | ARRAY BIOPHARMA INC (US) | 2015-08-26 | — | — | EP | disclosed |