⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL467835 | 0.71 | — | — | |
| SCHEMBL6270785 | 0.59 | — | — | |
| SCHEMBL8375510 | 0.56 | — | — | |
| SCHEMBL4870478 | 0.56 | — | — | |
| SCHEMBL6643246 | 0.56 | — | — | |
| SCHEMBL4365343 | 0.56 | — | — | |
| SCHEMBL11298277 | 0.56 | — | — | |
| SCHEMBL7075762 | 0.56 | — | — | |
| SCHEMBL7584130 | 0.54 | — | — | |
| SCHEMBL9736 | 0.54 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0001775-B1 | METHOD OF MAKING ADHESIVE-REPELLENT COATINGS BASED ON POLYSILOXANE, AND THEIR APPLICATION IN THE COATING OF PAPER | BAYER AG (DE) | 1982-05-12 | — | — | EP | claimed |
| US-4202929-A | POLYSILOXANES | BAYER ATKIENGESELLSCHAFT (DE) | 1980-05-13 | — | — | US | disclosed |