⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23692027 | 0.85 | ALDH1A1 (0.31) | — | |
| SCHEMBL19495349 | 0.83 | — | — | |
| SCHEMBL12810608 | 0.83 | NOS3 (0.30) | — | |
| SCHEMBL12702942 | 0.83 | NOS3 (0.30) | — | |
| SCHEMBL13816156 | 0.83 | — | — | |
| SCHEMBL18499741 | 0.75 | ALDH1A1 (0.38) | — | |
| SCHEMBL24977657 | 0.75 | — | — | |
| SCHEMBL20365724 | 0.75 | LMNA (0.32) | — | |
| SCHEMBL21126946 | 0.75 | — | — | |
| SCHEMBL8252195 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20220411627-A1 | EPOXY RESIN MIXTURE, EPOXY RESIN COMPOSITION AND CURED PRODUCT OF SAME | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2022-12-29 | — | — | US | disclosed |