⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9604654 | 0.89 | — | — | |
| SCHEMBL14866164 | 0.81 | MEN1 (0.34) | — | |
| SCHEMBL768793 | 0.69 | — | — | |
| SCHEMBL15277630 | 0.68 | — | — | |
| SCHEMBL1106135 | 0.67 | — | — | |
| SCHEMBL23175669 | 0.65 | MEN1 (0.32) | — | |
| SCHEMBL8737239 | 0.64 | — | — | |
| SCHEMBL12368446 | 0.64 | — | — | |
| SCHEMBL19598878 | 0.64 | — | — | |
| SCHEMBL26381067 | 0.62 | — | — |
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-20120135980-A1 | GAMMA SECRETASE MODULATORS | SCHERING CORPORATION | 2012-05-31 | — | — | US | disclosed |