⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18644555 | 0.91 | — | — | |
| SCHEMBL18758017 | 0.83 | ALDH1A1 (0.41) | — | |
| SCHEMBL18456062 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL18644376 | 0.75 | — | — | |
| SCHEMBL18400943 | 0.73 | ALDH1A1 (0.38) | — | |
| SCHEMBL18758021 | 0.67 | ALDH1A1 (0.42) | — | |
| SCHEMBL14300826 | 0.67 | — | — | |
| SCHEMBL18457108 | 0.67 | THRB (0.33) | — | |
| SCHEMBL18400945 | 0.64 | ALDH1A1 (0.42) | — | |
| SCHEMBL4844888 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11208509-B2 | Polymer compound for conductive polymer and method for producing same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2021-12-28 | — | — | US | disclosed |
| US-20200291145-A1 | POLYMER COMPOUND FOR CONDUCTIVE POLYMER AND METHOD FOR PRODUCING SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2020-09-17 | — | — | US | disclosed |