⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5698897 | 0.90 | HSD17B10 (0.31) | — | |
| SCHEMBL82400 | 0.84 | — | — | |
| SCHEMBL7638647 | 0.82 | ALDH1A1 (0.30) | — | |
| SCHEMBL7644187 | 0.82 | — | — | |
| SCHEMBL7635654 | 0.80 | CES2 (0.33) | — | |
| SCHEMBL5698868 | 0.77 | HSD17B10 (0.34) | — | |
| SCHEMBL7640148 | 0.76 | — | — | |
| SCHEMBL2779022 | 0.76 | — | — | |
| SCHEMBL7640196 | 0.74 | TSHR (0.41) | — | |
| SCHEMBL16286587 | 0.74 | — | — |
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-6399212-B1 | COATINGS WITH ORGANOSILICON COMPOUNDS AND SOLUTION OF SILICOFLUORIC ACID AND SILICON DIOXIDE | NIPPON SHEET GLASS CO., LTD. (JP) | 2002-06-04 | — | — | US | disclosed |
| EP-1094090-A2 | Silicon dioxide-coated polyolefin resin and process for its production | NIPPON SHEET GLASS CO. LTD. (JP) | 2001-04-25 | — | — | EP | disclosed |