⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3299276 | 0.78 | KIF11 (0.38) | — | |
| SCHEMBL3298745 | 0.76 | KIF11 (0.37) | — | |
| SCHEMBL3296696 | 0.76 | — | — | |
| SCHEMBL3293287 | 0.73 | KCNH2 (0.38) | — | |
| SCHEMBL3295112 | 0.72 | — | — | |
| SCHEMBL3294409 | 0.70 | — | — | |
| SCHEMBL3294501 | 0.69 | KIF11 (0.31) | — | |
| SCHEMBL31376345 | 0.66 | ERBB2 (0.36) | — | |
| SCHEMBL3818720 | 0.66 | ALDH1A1 (0.39) | — | |
| SCHEMBL3302655 | 0.66 | KCNH2 (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 |