⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12733710 | 0.80 | — | — | |
| SCHEMBL3245964 | 0.75 | — | — | |
| SCHEMBL15108060 | 0.72 | — | — | |
| SCHEMBL3245914 | 0.71 | — | — | |
| SCHEMBL2755073 | 0.70 | — | — | |
| SCHEMBL3250877 | 0.69 | — | — | |
| SCHEMBL27408096 | 0.68 | — | — | |
| SCHEMBL10082259 | 0.68 | — | — | |
| SCHEMBL27522020 | 0.67 | — | — | |
| SCHEMBL3806857 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100022573-A1 | INHIBITORS OF AKT ACTIVITY | MERCK SHARP & DOHME CORP. | 2010-01-28 | — | — | US | disclosed |