⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31217853 | 0.95 | TSHR (0.47) | — | |
| SCHEMBL64376 | 0.95 | — | — | |
| Ethylene SCHEMBL3719674 | 0.92 | — | — | |
| SCHEMBL4557324 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL669408 | 0.92 | — | — | |
| SCHEMBL2852893 | 0.92 | — | — | |
| SCHEMBL2577033 | 0.92 | — | — | |
| Methyl Alcohol SCHEMBL10631329 | 0.92 | — | — | |
| Phosphine SCHEMBL10881887 | 0.92 | — | — | |
| Ethane SCHEMBL9012185 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1054032-A2 | Siloxane emulsions | DOW CORNING S.A. (BE) | 2000-11-22 | — | — | EP | claimed |
| EP-1054032-B1 | Siloxane emulsions | DOW CORNING SA (BE) | 2007-10-03 | — | — | EP | disclosed |
| EP-1054032-A2 | Siloxane emulsions | DOW CORNING S.A. (BE) | 2000-11-22 | — | — | EP | disclosed |