⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9404499 | 0.74 | — | — | |
| SCHEMBL188014 | 0.67 | — | — | |
| SCHEMBL9229697 | 0.67 | — | — | |
| SCHEMBL4731857 | 0.62 | — | — | |
| SCHEMBL301943 | 0.62 | — | — | |
| SCHEMBL9227804 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL9231043 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL7939701 | 0.59 | ALDH1A1 (0.36) | — | |
| SCHEMBL7060460 | 0.59 | ALDH1A1 (0.46) | — | |
| SCHEMBL1644232 | 0.59 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8097745-B2 | Method of producing organosilicon compound | JSR CORPORATION (JP) | 2012-01-17 | — | — | US | disclosed |
| US-20110082309-A1 | METHOD OF PRODUCING ORGANOSILICON COMPOUND | JSR CORPORATION (JP) | 2011-04-07 | — | — | US | disclosed |
| US-7872053-B2 | Surface active organosilicone compounds | Momentive Performance Materials GmbH & Co., KG (DE) | 2011-01-18 | — | — | US | disclosed |
| EP-2125832-A1 | SURFACE ACTIVE ORGANOSILICONE COMPOUNDS | Momentive Performance Materials GmbH (DE) | 2009-12-02 | — | — | EP | disclosed |
| US-20080242743-A1 | Surface Active Organosilicone Compounds | MOMENTIVE PERFORMANCE MATERIALS GMBH & CO. KG (DE) | 2008-10-02 | — | — | US | disclosed |
| WO-2008116863-A1 | SURFACE ACTIVE ORGANOSILICONE COMPOUNDS | MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) | 2008-10-02 | — | — | WO | disclosed |