⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14548850 | 1.00 | — | — | |
| SCHEMBL17576278 | 1.00 | — | — | |
| SCHEMBL11919889 | 0.97 | — | — | |
| SCHEMBL11919892 | 0.90 | — | — | |
| SCHEMBL3893752 | 0.82 | — | — | |
| SCHEMBL10634771 | 0.76 | — | — | |
| SCHEMBL10631911 | 0.76 | — | — | |
| SCHEMBL779478 | 0.76 | — | — | |
| SCHEMBL776082 | 0.76 | — | — | |
| SCHEMBL19864590 | 0.75 | ALDH1A1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021020289-A1 | POLYARYLENE SULFIDE RESIN FILM, METAL LAYERED PRODUCT, PRODUCTION METHOD FOR POLYARYLENE SULFIDE RESIN FILM, AND PRODUCTION METHOD FOR METAL LAYERED PRODUCT | 東レ株式会社 | 2021-02-04 | — | — | WO | disclosed |
| US-9946157-B2 | Resist composition and method for producing resist pattern | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2018-04-17 | — | — | US | disclosed |