⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL919992 | 1.00 | — | — | |
| SCHEMBL24017050 | 0.84 | OPRM1 (0.40) | — | |
| SCHEMBL428264 | 0.84 | OPRM1 (0.40) | — | |
| SCHEMBL1039817 | 0.81 | CYP2D6 (0.65) | — | |
| SCHEMBL9813143 | 0.80 | LMNA (0.48) | — | |
| SCHEMBL29092693 | 0.80 | LMNA (0.46) | — | |
| SCHEMBL11590828 | 0.80 | LMNA (0.46) | — | |
| SCHEMBL10798213 | 0.79 | CYP2D6 (0.69) | — | |
| SCHEMBL7117416 | 0.78 | — | — | |
| SCHEMBL14543848 | 0.78 | — | — |
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-118271615-A | Sulfur-containing polymer-based optical material with high light transmittance, high refraction and low dispersion and preparation method thereof | 常州汉韦聚合物有限公司 | 2024-07-02 | — | — | CN | claimed |