⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL217199 | 0.78 | — | — | |
| SCHEMBL11913571 | 0.73 | — | — | |
| SCHEMBL3687652 | 0.71 | — | — | |
| SCHEMBL5711909 | 0.69 | — | — | |
| SCHEMBL5711905 | 0.69 | — | — | |
| SCHEMBL5701564 | 0.69 | — | — | |
| SCHEMBL4273351 | 0.65 | — | — | |
| SCHEMBL13210314 | 0.65 | — | — | |
| SCHEMBL18719913 | 0.65 | — | — | |
| SCHEMBL9891727 | 0.65 | — | — |
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-2016145277-A1 | METHOD OF REMOVING A VOLATILE ORGANOPOLYSILOXANE FROM A MIXTURE COMPRISING AN INERT GAS AND THE VOLATILE ORGANOPOLYSILOXANE | DOW CORNING CORPORATION (US) | 2016-09-15 | — | — | WO | disclosed |