⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14923068 | 0.77 | — | — | |
| SCHEMBL14849201 | 0.74 | — | — | |
| SCHEMBL15304094 | 0.72 | — | — | |
| SCHEMBL19507890 | 0.72 | — | — | |
| SCHEMBL16901603 | 0.71 | — | — | |
| SCHEMBL17225905 | 0.70 | — | — | |
| SCHEMBL16329018 | 0.70 | — | — | |
| SCHEMBL6051803 | 0.70 | — | — | |
| SCHEMBL1470038 | 0.70 | — | — | |
| SCHEMBL16383786 | 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-20130150458-A1 | SILICONE-MODIFIED WAX, COMPOSITION AND COSMETIC PREPARATION CONTAINING THE SAME, AND PRODUCTION METHOD OF SILICONE-MODIFIED WAX | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2013-06-13 | — | — | US | disclosed |