⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9695768 | 0.78 | — | — | |
| SCHEMBL29069092 | 0.78 | — | — | |
| SCHEMBL133471 | 0.74 | — | — | |
| SCHEMBL27568777 | 0.74 | — | — | |
| SCHEMBL28265825 | 0.74 | — | — | |
| SCHEMBL16230351 | 0.74 | — | — | |
| SCHEMBL7939719 | 0.73 | — | — | |
| SCHEMBL13385825 | 0.73 | — | — | |
| SCHEMBL3630568 | 0.71 | — | — | |
| SCHEMBL29001451 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4894483-A | Preparation of vinylglyoxal derivatives, novel vinylglyoxal derivatives and their use | BASF AKTIENGESELLSCHAFT (DE) | 1990-01-16 | — | — | US | claimed |
| EP-0267537-B1 | PROCESS FOR THE PREPARATION OF VINYLGLYOXAL DERIVATIVES, VINYLGLYOXAL DERIVATIVES AND THEIR USE | BASF Aktiengesellschaft (DE) | 1992-01-08 | — | — | EP | disclosed |
| US-4894483-A | Preparation of vinylglyoxal derivatives, novel vinylglyoxal derivatives and their use | BASF AKTIENGESELLSCHAFT (DE) | 1990-01-16 | — | — | US | disclosed |
| EP-0267537-A2 | Process for the preparation of vinylglyoxal derivatives, vinylglyoxal derivatives and their use | BASF Aktiengesellschaft (DE) | 1988-05-18 | — | — | EP | disclosed |