⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2719690 | 0.71 | — | — | |
| SCHEMBL7386206 | 0.70 | CHRM2 (0.35) | — | |
| SCHEMBL7702577 | 0.69 | — | — | |
| SCHEMBL16878868 | 0.65 | — | — | |
| SCHEMBL1726544 | 0.65 | — | — | |
| SCHEMBL5665718 | 0.64 | — | — | |
| SCHEMBL11245 | 0.59 | CHRM2 (0.36) | — | |
| SCHEMBL14543103 | 0.59 | CHRM2 (0.36) | — | |
| SCHEMBL7274558 | 0.59 | — | — | |
| SCHEMBL3225590 | 0.59 | — | — |
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-11777142-B2 | Gelable system containing ether compounds, preparation method therefor and use thereof | BEIJING NORMAL UNIVERSITY (CN) | 2023-10-03 | — | — | US | disclosed |
| US-20200099096-A1 | Gelable System Containing Ether Compounds, Preparation Method Therefor and Use Thereof | BEIJING NORMAL UNIVERSITY (CN) | 2020-03-26 | — | — | US | disclosed |
| WO-2013041468-A1 | BENZOIC ACID DERIVATIVES AS EIF4E INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-03-28 | — | — | WO | disclosed |