⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20451239 | 0.84 | — | — | |
| SCHEMBL16379069 | 0.75 | — | — | |
| SCHEMBL19457726 | 0.74 | — | — | |
| SCHEMBL47730 | 0.71 | — | — | |
| SCHEMBL16379064 | 0.70 | — | — | |
| SCHEMBL3867706 | 0.69 | — | — | |
| SCHEMBL31676684 | 0.69 | — | — | |
| SCHEMBL1696049 | 0.67 | — | — | |
| SCHEMBL1701832 | 0.67 | — | — | |
| SCHEMBL5252842 | 0.67 | — | — |
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-0435654-B1 | Process for producing hydrogensiloxanes | SHINETSU CHEMICAL CO (JP) | 1994-09-14 | — | — | EP | disclosed |
| US-5097054-A | Reacting chlorosilanes with 1,1,3,3-tetramethyldisiloxane in presence of water and acid | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1992-03-17 | — | — | US | disclosed |
| EP-0435654-A1 | Process for producing hydrogensiloxanes | Shin-Etsu Chemical Co., Ltd. (JP) | 1991-07-03 | — | — | EP | disclosed |