⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20078069 | 0.85 | — | — | |
| SCHEMBL20078068 | 0.82 | — | — | |
| SCHEMBL3170116 | 0.79 | — | — | |
| SCHEMBL3173045 | 0.79 | — | — | |
| SCHEMBL20078067 | 0.75 | — | — | |
| SCHEMBL5161465 | 0.74 | — | — | |
| SCHEMBL5161457 | 0.74 | — | — | |
| SCHEMBL13145851 | 0.74 | — | — | |
| SCHEMBL10316320 | 0.73 | — | — | |
| SCHEMBL5701340 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1453888-B1 | SACCHARIDE RESIDUE-FUNCTIONAL ORGANOPOLYCARBOSILOXANES AND METHOD FOR THE PREPARATION THEREOF | DOW CORNING TORAY CO LTD (JP) | 2007-03-14 | — | — | EP | disclosed |