⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10593158 | 0.81 | — | — | |
| SCHEMBL1253675 | 0.81 | — | — | |
| SCHEMBL159337 | 0.76 | — | — | |
| SCHEMBL7792946 | 0.73 | — | — | |
| SCHEMBL81023 | 0.73 | — | — | |
| SCHEMBL3198617 | 0.72 | — | — | |
| SCHEMBL5082391 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL26092918 | 0.71 | LMNA (0.57) | — | |
| SCHEMBL2579548 | 0.70 | — | — | |
| SCHEMBL17396296 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008128819-A1 | MIXTURE CONTAINING ORGANOSILICON COMPOUND AND USE THEREOF | EVONIK DEGUSSA GMBH (DE) | 2008-10-30 | — | — | WO | disclosed |