⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1623712 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL1623922 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL1623911 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL11116747 | 0.70 | — | — | |
| SCHEMBL163574 | 0.70 | — | — | |
| SCHEMBL163573 | 0.70 | — | — | |
| SCHEMBL1673409 | 0.69 | — | — | |
| SCHEMBL9168851 | 0.69 | — | — | |
| SCHEMBL11328578 | 0.68 | ALDH1A1 (0.32) | — | |
| SCHEMBL27374432 | 0.68 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4365074-A | ACRYLIC ESTER COPOLYMERS | Tsuetaki, George F. (US) | 1982-12-21 | — | — | US | disclosed |
| US-4314068-A | Oxygen-permeable contact lens compositions, methods, and articles of manufacture | Tsuetaki, George F. (US) | 1982-02-02 | — | — | US | disclosed |
| US-4216303-A | Oxygen-permeable contact lens compositions, methods and articles of manufacture | Tsuetaki, George F. (US) | 1980-08-05 | — | — | US | disclosed |