⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6965755 | 1.00 | — | — | |
| SCHEMBL9429074 | 1.00 | — | — | |
| SCHEMBL17224962 | 0.79 | — | — | |
| SCHEMBL9516454 | 0.79 | — | — | |
| SCHEMBL9464668 | 0.79 | — | — | |
| SCHEMBL9464218 | 0.79 | — | — | |
| SCHEMBL17224961 | 0.79 | — | — | |
| SCHEMBL8569989 | 0.77 | — | — | |
| SCHEMBL9429335 | 0.77 | — | — | |
| SCHEMBL6969356 | 0.77 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |
| EP-0257294-B1 | E/Z-ISOMERIC MIXTURES AND PURE Z-ISOMERS OF N-ALPHA-(2-CYANO-2-ALKOXYIMINOACETYL) AMINO-ACID DERIVATIVES AND LIKE PEPTIDES | BAYER AG (DE) | 1990-09-12 | — | — | EP | disclosed |
| EP-0257295-B1 | (Z)-2-CYANO-2-OXIMINO-ACETYL CHLORIDES, AND PROCESS FOR THEIR PREPARATION | BAYER AG (DE) | 1990-08-29 | — | — | EP | disclosed |
| US-4904811-A | (Z)-2-cyano-2-oximino-acetyl chlorides | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-27 | — | — | US | disclosed |
| EP-0257295-A1 | (Z)-2-cyano-2-oximino-acetyl chlorides, and process for their preparation | BAYER AG (DE) | 1988-03-02 | — | — | EP | disclosed |
| EP-0257294-A1 | E/Z-isomeric mixtures and pure Z-isomers of N-alpha-(2-cyano-2-alkoxyiminoacetyl) amino-acid derivatives and like peptides | BAYER AG (DE) | 1988-03-02 | — | — | EP | disclosed |
| EP-0201999-A1 | Substituted 2-cyano-2-oximino-acetamides, processes for their production and their use as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-11-20 | — | — | EP | disclosed |