⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7635502 | 0.94 | — | — | |
| SCHEMBL7634248 | 0.88 | — | — | |
| SCHEMBL7626727 | 0.86 | NR1H2 (0.33) | — | |
| SCHEMBL7631209 | 0.86 | — | — | |
| SCHEMBL7633891 | 0.84 | LMNA (0.33) | — | |
| SCHEMBL7632708 | 0.83 | F2 (0.32) | — | |
| SCHEMBL7630197 | 0.82 | — | — | |
| SCHEMBL7633267 | 0.81 | — | — | |
| SCHEMBL7633168 | 0.80 | ESR1 (0.32) | — | |
| SCHEMBL7627324 | 0.80 | ALDH1A1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1233014-A1 | ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME | NOF CORPORATION (JP) | 2002-08-21 | — | — | EP | disclosed |