⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20215479 | 0.91 | — | — | |
| SCHEMBL20820948 | 0.81 | — | — | |
| SCHEMBL19457779 | 0.81 | — | — | |
| SCHEMBL20215497 | 0.79 | — | — | |
| SCHEMBL21599229 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL18457347 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL18844174 | 0.74 | — | — | |
| SCHEMBL111963 | 0.73 | — | — | |
| SCHEMBL10115802 | 0.73 | — | — | |
| SCHEMBL18476617 | 0.73 | — | — |
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-9790166-B2 | Polymer, monomer, resist composition, and patterning process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-10-17 | — | — | US | disclosed |