⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27552296 | 0.84 | ALOX15 (0.30) | — | |
| SCHEMBL28118898 | 0.83 | LMNA (0.31) | — | |
| SCHEMBL5996774 | 0.80 | — | — | |
| Urea SCHEMBL1483244 | 0.76 | ALOX15 (0.39) | — | |
| Urea SCHEMBL5532577 | 0.76 | ALOX15 (0.39) | — | |
| SCHEMBL24959 | 0.74 | — | — | |
| Urea SCHEMBL28017752 | 0.74 | ALOX15 (0.37) | — | |
| Carbamic Acid SCHEMBL29039766 | 0.74 | ALOX15 (0.37) | — | |
| SCHEMBL27521118 | 0.73 | — | — | |
| Acrylic Acid SCHEMBL28637637 | 0.73 | LMNA (0.40) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103030734-A | Core-shell type acrylate emulsion and preparation method thereof | QINGDAO SHENGHAN CHROMATOGRAPHY TECHNOLOGY CO LTD | 2013-04-10 | — | — | CN | disclosed |