⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21708102 | 0.81 | ALDH1A1 (0.30) | — | |
| SCHEMBL19861719 | 0.72 | — | — | |
| SCHEMBL18831907 | 0.71 | — | — | |
| SCHEMBL15962875 | 0.71 | — | — | |
| SCHEMBL23075658 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL23075667 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL881172 | 0.68 | ALDH1A1 (0.45) | — | |
| SCHEMBL18813938 | 0.68 | ALDH1A1 (0.30) | — | |
| SCHEMBL23921828 | 0.68 | — | — | |
| SCHEMBL19646654 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10038216-B2 | PEO-based graft copolymers with pendant fluorinated groups for use as electrolytes | SEEO, INC. (US) | 2018-07-31 | — | — | US | disclosed |