⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16327711 | 0.77 | ALDH1A1 (0.41) | — | |
| SCHEMBL7199463 | 0.72 | — | — | |
| SCHEMBL28235551 | 0.72 | — | — | |
| SCHEMBL14390529 | 0.72 | — | — | |
| SCHEMBL12348388 | 0.72 | — | — | |
| SCHEMBL12105733 | 0.72 | — | — | |
| SCHEMBL19774819 | 0.69 | — | — | |
| SCHEMBL8381149 | 0.67 | — | — | |
| SCHEMBL9241020 | 0.67 | — | — | |
| SCHEMBL25237284 | 0.67 | MEN1 (0.39) | — |
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-108137641-B | Cyclic dinucleotide compounds as sting agonists | 默沙东公司 | 2022-04-01 | — | — | CN | disclosed |
| CN-109694397-A | Cyclic annular dinucleotides compound, preparation method and application | 上海弘翊生物科技有限公司 | 2019-04-30 | — | — | CN | disclosed |
| CN-106459131-B | Cyclic annular dinucleotides as STING regulator | 葛兰素史克知识产权开发有限公司 | 2019-04-12 | — | — | CN | disclosed |
| CN-106459131-A | Cyclic di-nucleotides as modulators of STING | 葛兰素史克知识产权开发有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-105073768-A | Ras inhibitors and uses thereof | DANA FARBER CANCER INST INC | 2015-11-18 | — | — | CN | disclosed |