⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL705739 | 0.75 | — | — | |
| SCHEMBL645820 | 0.73 | — | — | |
| SCHEMBL8204516 | 0.70 | — | — | |
| Butadiene SCHEMBL9513725 | 0.69 | — | — | |
| Butadiene SCHEMBL8927776 | 0.68 | — | — | |
| SCHEMBL3948356 | 0.67 | — | — | |
| SCHEMBL16823360 | 0.66 | — | — | |
| SCHEMBL28012254 | 0.65 | — | — | |
| SCHEMBL431503 | 0.64 | — | — | |
| SCHEMBL28630893 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101479342-B | Preparation of silicone rubber elastomers | DOW CORNING INC | 2011-08-17 | — | — | CN | disclosed |
| CN-101479342-A | Preparation of silicone rubber elastomers | DOW CORNING (US) | 2009-07-08 | — | — | CN | disclosed |