⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2139381 | 0.84 | — | — | |
| SCHEMBL10799347 | 0.82 | — | — | |
| SCHEMBL7381748 | 0.73 | USP2 (0.35) | — | |
| SCHEMBL3176188 | 0.72 | — | — | |
| SCHEMBL11062500 | 0.67 | — | — | |
| SCHEMBL28416504 | 0.66 | — | — | |
| SCHEMBL1804278 | 0.65 | — | — | |
| SCHEMBL28242396 | 0.62 | — | — | |
| SCHEMBL355892 | 0.62 | — | — | |
| SCHEMBL444155 | 0.62 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109912516-A | A kind of environment-friendly preparation method thereof with the promotion active 1,2,3,4- tetrahydropyrimidine ketone compound of SOD | 河南湾流生物科技有限公司 | 2019-06-21 | — | — | CN | claimed |
| CN-105801491-B | The synthetic method of 3,4 dihydro-pyrimidin ketones derivants | 江苏科技大学 | 2018-04-17 | — | — | CN | claimed |
| CN-105801491-A | Synthesizing method for 3,4-dihydropyrimidinone derivative | 江苏科技大学 | 2016-07-27 | — | — | CN | claimed |
| CN-109912516-A | A kind of environment-friendly preparation method thereof with the promotion active 1,2,3,4- tetrahydropyrimidine ketone compound of SOD | 河南湾流生物科技有限公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-109912516-A | A kind of environment-friendly preparation method thereof with the promotion active 1,2,3,4- tetrahydropyrimidine ketone compound of SOD | 河南湾流生物科技有限公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-109912516-A | A kind of environment-friendly preparation method thereof with the promotion active 1,2,3,4- tetrahydropyrimidine ketone compound of SOD | 河南湾流生物科技有限公司 | 2019-06-21 | — | — | CN | disclosed |