⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13621411 | 0.87 | — | — | |
| SCHEMBL264828 | 0.84 | — | — | |
| SCHEMBL22344183 | 0.81 | — | — | |
| SCHEMBL19575237 | 0.75 | — | — | |
| SCHEMBL373607 | 0.71 | — | — | |
| SCHEMBL140661 | 0.71 | — | — | |
| SCHEMBL13484598 | 0.71 | — | — | |
| SCHEMBL13621365 | 0.71 | — | — | |
| SCHEMBL16087657 | 0.71 | — | — | |
| SCHEMBL12264073 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8304571-B2 | Perfluoropolyether-modified polysiloxane, a method for preparing the same and a defoaming agent comprising the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2012-11-06 | — | — | US | disclosed |
| US-8129435-B2 | Perfluoropolyether-modified polysiloxane, a method for preparing the same and a defoaming agent comprising the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2012-03-06 | — | — | US | disclosed |
| US-20110015420-A1 | PERFLUOROPOLYETHER-MODIFIED POLYSILOXANE, A METHOD FOR PREPARING THE SAME AND A DEFOAMING AGENT COMPRISING THE SAME | SHIN-ETSU CHEMICAL CO., LTD (JP) | 2011-01-20 | — | — | US | disclosed |