⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3298052 | 0.83 | — | — | |
| SCHEMBL3294363 | 0.81 | CYP3A4 (0.31) | — | |
| SCHEMBL3303344 | 0.79 | — | — | |
| SCHEMBL3294501 | 0.78 | KIF11 (0.31) | — | |
| SCHEMBL3294263 | 0.74 | — | — | |
| SCHEMBL3296696 | 0.74 | — | — | |
| SCHEMBL3296580 | 0.73 | — | — | |
| SCHEMBL3299246 | 0.71 | — | — | |
| SCHEMBL3297583 | 0.71 | SHBG (0.41) | — | |
| SCHEMBL3517534 | 0.71 | CYP3A4 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7741393-B2 | Organic silicon-based compound and method of producing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-06-22 | — | — | US | disclosed |
| US-20070203275-A1 | Organic Silicon-Based Compound And Method Of Producing The Same | SUMITOMO CHEMICAL COMPANY, LIMITED | 2007-08-30 | — | — | US | disclosed |