⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9618100 | 1.00 | — | — | |
| Acetic Acid SCHEMBL9021793 | 0.90 | MAPT (0.33) | — | |
| SCHEMBL8569989 | 0.77 | — | — | |
| SCHEMBL6969365 | 0.77 | — | — | |
| SCHEMBL11681510 | 0.77 | — | — | |
| SCHEMBL9429335 | 0.77 | — | — | |
| SCHEMBL11681511 | 0.77 | — | — | |
| SCHEMBL6969360 | 0.73 | — | — | |
| SCHEMBL6969356 | 0.73 | — | — | |
| SCHEMBL7476558 | 0.72 | — | — |
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-105330612-A | Synthesis process of 2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)acetic acid | SHANGHAI TITAN TECHNOLOGY CO LTD | 2016-02-17 | — | — | CN | claimed |
| JP-4077463-A | — | — | None | — | — | JP | disclosed |
| CN-105330612-A | Synthesis process of 2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)acetic acid | SHANGHAI TITAN TECHNOLOGY CO LTD | 2016-02-17 | — | — | CN | disclosed |
| JP-H0477463-A | PRODUCTION OF 2-CYANO-2-SUBSTITUTED HYDROXYIMINOACETAMIDINE | TAKEDA CHEM IND LTD | 1992-03-11 | — | — | JP | disclosed |