⚠ 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 | |
|---|---|---|---|---|
| Sulfurous Acid SCHEMBL3691712 | 0.78 | — | — | |
| Sulfurous Acid SCHEMBL476246 | 0.76 | — | — | |
| Sulfurous Acid SCHEMBL27541636 | 0.76 | CA1 (0.60) | — | |
| SCHEMBL27699433 | 0.75 | CA1 (0.36) | — | |
| Sulfurous Acid SCHEMBL3990309 | 0.74 | CA1 (1.00) | — | |
| Sulfurous Acid SCHEMBL146059 | 0.74 | — | — | |
| Sulfurous Acid SCHEMBL3181 | 0.74 | — | — | |
| SCHEMBL2707822 | 0.74 | — | — | |
| Sulfurous Acid SCHEMBL11795102 | 0.73 | — | — | |
| Sulfurous Acid SCHEMBL29002916 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101386490-B | Allyl polyglycol ether type polycarboxylic acid series dehydragent and preparation method thereof | BEIJING INST CIVIL ENG & ARCH | 2011-10-05 | — | — | CN | disclosed |
| CN-101386490-A | Allyl polyglycol ether type polycarboxylic acid series dehydragent and preparation method thereof | BEIJING INST OF CIVIL ENGINEER (CN) | 2009-03-18 | — | — | CN | disclosed |