⚠ 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 | |
|---|---|---|---|---|
| Ether SCHEMBL20550101 | 1.00 | ALDH1A1 (0.32) | — | |
| Ether SCHEMBL11500475 | 0.87 | MEN1 (0.40) | — | |
| Triethylene Glycol SCHEMBL9170903 | 0.81 | ALDH1A1 (0.54) | — | |
| Ether SCHEMBL10359966 | 0.80 | ALDH1A1 (0.32) | — | |
| Vinyl Ether SCHEMBL388628 | 0.80 | ALDH1A1 (0.32) | — | |
| Vinyl Ether SCHEMBL412817 | 0.80 | ALDH1A1 (0.32) | — | |
| Ether SCHEMBL1766220 | 0.79 | ALDH1A1 (0.35) | — | |
| Ether SCHEMBL21930394 | 0.79 | — | — | |
| Ether SCHEMBL1001468 | 0.79 | ALDH1A1 (0.35) | — | |
| Ether SCHEMBL5027455 | 0.79 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1016697-B | Process for preparing olefin/carbon monoxide copolymer | SHELL INT RESEARCH (NL) | 1992-05-20 | — | — | CN | disclosed |
| EP-0410794-A2 | Maleimide containing, negative working deep UV photoresist | HOECHST CELANESE CORPORATION (US) | 1991-01-30 | — | — | EP | disclosed |
| US-4980264-A | Photoresist compositions of controlled dissolution rate in alkaline developers | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 1990-12-25 | — | — | US | disclosed |
| CN-87107201-A | Method for preparation of olefinlco copolymers | — | 1988-06-15 | — | — | CN | disclosed |