⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12022923 | 1.00 | — | — | |
| SCHEMBL12909819 | 1.00 | — | — | |
| SCHEMBL8825659 | 1.00 | — | — | |
| SCHEMBL3749481 | 0.95 | — | — | |
| SCHEMBL3868343 | 0.87 | — | — | |
| SCHEMBL4761256 | 0.87 | — | — | |
| SCHEMBL9004508 | 0.87 | — | — | |
| SCHEMBL9004493 | 0.87 | — | — | |
| SCHEMBL11950506 | 0.87 | — | — | |
| SCHEMBL9004473 | 0.87 | — | — |
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-8398964-B2 | Organopolysiloxane having amide group, and cosmetic material containing same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2013-03-19 | — | — | US | disclosed |