⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15104972 | 0.92 | — | — | |
| SCHEMBL2198239 | 0.88 | — | — | |
| SCHEMBL2197798 | 0.86 | EPHX1 (0.42) | — | |
| SCHEMBL11565964 | 0.83 | — | — | |
| SCHEMBL2199616 | 0.81 | EPHX1 (0.47) | — | |
| SCHEMBL12677249 | 0.80 | EPHX1 (0.76) | — | |
| SCHEMBL2198455 | 0.80 | EPHX1 (0.45) | — | |
| SCHEMBL7786789 | 0.78 | EPHX1 (0.48) | — | |
| SCHEMBL20597382 | 0.78 | EPHX1 (0.48) | — | |
| SCHEMBL5361321 | 0.78 | EPHX1 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111247141-B | Epoxy-oxetane compound, method for synthesizing the same, and use of the compound | 四国化成工业株式会社 | 2023-12-29 | — | — | CN | disclosed |
| CN-111247141-A | Epoxy-oxetane compound, method for synthesizing same, and use of same | 四国化成工业株式会社 | 2020-06-05 | — | — | CN | disclosed |