⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14915911 | 1.00 | — | — | |
| SCHEMBL2051575 | 0.86 | F11 (0.39) | — | |
| SCHEMBL2051577 | 0.86 | F11 (0.39) | — | |
| SCHEMBL1352689 | 0.75 | F11 (0.41) | — | |
| SCHEMBL1352688 | 0.75 | F11 (0.41) | — | |
| SCHEMBL513972 | 0.74 | HSD11B1 (0.36) | — | |
| SCHEMBL513971 | 0.74 | HSD11B1 (0.36) | — | |
| SCHEMBL2730186 | 0.74 | F11 (0.41) | — | |
| SCHEMBL1352045 | 0.74 | F11 (0.36) | — | |
| SCHEMBL1352044 | 0.74 | F11 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9221838-B2 | Inhibitors of AKT activity | ALMAC DISCOVERY LIMITED (IE) | 2015-12-29 | — | — | US | disclosed |
| US-20130116243-A1 | INHIBITORS OF AKT ACTIVITY | ALMAC DISCOVERY LIMITED (GB) | 2013-05-09 | — | — | US | disclosed |