⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6829695 | 0.76 | GRIN2D (0.32) | — | |
| SCHEMBL7711858 | 0.72 | ALDH1A1 (0.34) | — | |
| SCHEMBL27608641 | 0.70 | LMNA (0.33) | — | |
| SCHEMBL17322714 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL5917724 | 0.70 | ALDH1A1 (0.38) | — | |
| SCHEMBL547650 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL5518193 | 0.69 | EPHX2 (0.33) | — | |
| SCHEMBL548175 | 0.69 | EPHX2 (0.32) | — | |
| SCHEMBL7263732 | 0.69 | GRIN2D (0.31) | — | |
| SCHEMBL134073 | 0.68 | ALDH1A1 (0.31) | — |
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-6743885-B2 | MIXTURE OF POLYSILSESQUIOXANE AND ACID GENERATOR | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-06-01 | — | — | US | disclosed |
| US-20030092854-A1 | Resin composition for intermediate layer of three-layer resist | SUMITOMO CHEMICAL COMPANY, LIMITED | 2003-05-15 | — | — | US | disclosed |