⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6846231 | 0.77 | LMNA (0.32) | — | |
| SCHEMBL4340641 | 0.77 | ALDH1A1 (0.38) | — | |
| SCHEMBL27342264 | 0.75 | CA1 (0.40) | — | |
| SCHEMBL1683664 | 0.74 | — | — | |
| SCHEMBL3192666 | 0.74 | KDM4E (0.32) | — | |
| SCHEMBL28781241 | 0.72 | ALDH1A1 (0.39) | — | |
| SCHEMBL5926963 | 0.72 | MGAM (0.43) | — | |
| SCHEMBL28532070 | 0.72 | — | — | |
| SCHEMBL17686899 | 0.72 | ALDH1A1 (0.38) | — | |
| Ammonia Solution, Strong SCHEMBL28026699 | 0.72 | ALDH1A1 (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109536087-B | Optical pressure-sensitive adhesive and preparation method thereof | 苏州凡赛特材料科技有限公司 | 2021-03-19 | — | — | CN | disclosed |
| WO-2016014864-A1 | HYDROXY-(R)-2,2'-BISMETHYLNAL TREXONES AND USES THEREOF | SALIX PHARMACEUTICALS, INC. (US) | 2016-01-28 | — | — | WO | disclosed |
| US-20060033076-A1 | Silicate-free cooling liquids based on organic acids and carbamates having improved corrosion properties | CLARIANT GMBH | 2006-02-16 | — | — | US | disclosed |