⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23833210 | 0.82 | — | — | |
| SCHEMBL27617110 | 0.81 | ADORA3 (0.30) | — | |
| SCHEMBL29638783 | 0.73 | — | — | |
| SCHEMBL29768627 | 0.68 | — | — | |
| SCHEMBL29440550 | 0.64 | — | — | |
| SCHEMBL7855060 | 0.63 | — | — | |
| SCHEMBL28485691 | 0.61 | — | — | |
| SCHEMBL3843322 | 0.58 | — | — | |
| SCHEMBL629378 | 0.58 | — | — | |
| SCHEMBL629380 | 0.58 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107709305-B | Novel compound | 葛兰素史克知识产权开发有限公司 | 2020-09-29 | — | — | CN | claimed |
| CN-114728006-A | Methods of treating coronavirus infection | 苏州亚盛药业有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-107709305-B | Novel compound | 葛兰素史克知识产权开发有限公司 | 2020-09-29 | — | — | CN | disclosed |