⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9249500 | 1.00 | — | — | |
| SCHEMBL13118674 | 1.00 | — | — | |
| Thiophene SCHEMBL28277088 | 0.79 | — | — | |
| SCHEMBL27671514 | 0.72 | — | — | |
| SCHEMBL2862589 | 0.69 | — | — | |
| SCHEMBL2862592 | 0.69 | — | — | |
| SCHEMBL13118698 | 0.69 | — | — | |
| SCHEMBL28440391 | 0.69 | — | — | |
| SCHEMBL11495563 | 0.67 | — | — | |
| SCHEMBL11163142 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| EP-0428460-B1 | Dienoxysilanes, methods for their preparation and alpha-ethylenic alpha-halo-aldehydes accessible therefrom | UNIV ROUEN (FR) | 1995-03-29 | — | — | EP | disclosed |
| US-5113007-A | DIENOXYSILANES | UNIVERSITE DE ROUEN (FR) | 1992-05-12 | — | — | US | disclosed |
| EP-0432068-A1 | Process for the preparation of alpha-ethylene alpha-aminoaldehydes and compounds produced therefrom | UNIVERSITE DE ROUEN (FR) | 1991-06-12 | — | — | EP | disclosed |
| EP-0428460-A1 | Dienoxysilanes, methods for their preparation and alpha-ethylenic alpha-halo-aldehydes accessible therefrom | UNIVERSITE DE ROUEN (FR) | 1991-05-22 | — | — | EP | disclosed |