⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16728745 | 0.74 | — | — | |
| SCHEMBL8715614 | 0.71 | — | — | |
| SCHEMBL23781320 | 0.71 | — | — | |
| SCHEMBL3697817 | 0.68 | — | — | |
| SCHEMBL23293756 | 0.63 | — | — | |
| SCHEMBL13380887 | 0.62 | — | — | |
| SCHEMBL14926514 | 0.61 | — | — | |
| SCHEMBL7769057 | 0.61 | — | — | |
| SCHEMBL179845 | 0.60 | — | — | |
| SCHEMBL6895736 | 0.60 | — | — |
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-8110065-B2 | Heat-curable fluoropolyether adhesive composition and bonding method | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2012-02-07 | — | — | US | disclosed |