⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9619091 | 0.79 | ADRA2B (0.31) | — | |
| SCHEMBL9635139 | 0.71 | ELANE (0.34) | — | |
| SCHEMBL9634883 | 0.70 | CYP1A1 (0.30) | — | |
| SCHEMBL2220254 | 0.69 | LMNA (0.42) | — | |
| SCHEMBL23617109 | 0.68 | NLRP3 (0.38) | — | |
| SCHEMBL7206921 | 0.67 | — | — | |
| SCHEMBL2069873 | 0.66 | MCHR1 (0.46) | — | |
| SCHEMBL9635146 | 0.66 | ALDH1A1 (0.30) | — | |
| SCHEMBL9349556 | 0.64 | ADRA2B (0.40) | — | |
| SCHEMBL9634890 | 0.64 | — | — |
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-5102966-A | Addition polymerization of unsaturated ethers using an unsaturated alkenyl polyether adduct as initiator and a cation-donating compound | SEKISUI CHEMICAL CO., LTD. (JP) | 1992-04-07 | — | — | US | disclosed |