⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7796366 | 0.79 | FDPS (0.34) | — | |
| SCHEMBL7788261 | 0.77 | — | — | |
| SCHEMBL19066387 | 0.77 | CA5A (0.31) | — | |
| SCHEMBL9018535 | 0.77 | — | — | |
| SCHEMBL884189 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL28064105 | 0.75 | — | — | |
| SCHEMBL11230423 | 0.75 | — | — | |
| SCHEMBL355733 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL2355179 | 0.74 | — | — | |
| SCHEMBL2517323 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106608947-B | Tackifier are copolymerized associated matter and preparation method thereof | 中国石油化工股份有限公司 | 2019-01-25 | — | — | CN | claimed |
| CN-105085330-A | Synthesis method of N-methyldiallyl propanesulfonate (MAPS) | CHINA PETROLEUM & CHEMICAL | 2015-11-25 | — | — | CN | claimed |
| CN-106608972-B | A kind of preparation method of tackifier copolymerization associated matter | 中国石油化工股份有限公司 | 2019-05-21 | — | — | CN | disclosed |
| CN-106609129-B | A kind of tackifier copolymerization associated matter and preparation method thereof | 中国石油化工股份有限公司 | 2019-03-19 | — | — | CN | disclosed |
| CN-105085330-A | Synthesis method of N-methyldiallyl propanesulfonate (MAPS) | CHINA PETROLEUM & CHEMICAL | 2015-11-25 | — | — | CN | disclosed |