⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5312856 | 0.78 | FDPS (0.32) | — | |
| SCHEMBL11526816 | 0.76 | — | — | |
| SCHEMBL908616 | 0.74 | ALDH1A1 (0.44) | — | |
| SCHEMBL1548799 | 0.72 | — | — | |
| SCHEMBL26655448 | 0.70 | ALDH1A1 (0.33) | — | |
| Ethylene Glycol SCHEMBL2336848 | 0.68 | ALDH1A1 (0.38) | — | |
| SCHEMBL27717428 | 0.68 | — | — | |
| SCHEMBL11517964 | 0.67 | PEPD (0.32) | — | |
| SCHEMBL10780315 | 0.65 | — | — | |
| SCHEMBL11517972 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4138300-A | Process for producing a transparent shaped polymeric product | JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) | 1979-02-06 | — | — | US | disclosed |
| US-4138538-A | Process for producing a transparent shaped polymeric product | JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) | 1979-02-06 | — | — | US | disclosed |