⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22043516 | 0.67 | — | — | |
| SCHEMBL29238318 | 0.64 | DRD4 (0.34) | — | |
| SCHEMBL21240975 | 0.63 | — | — | |
| SCHEMBL22761167 | 0.62 | — | — | |
| SCHEMBL30311284 | 0.61 | EPHX2 (0.39) | — | |
| SCHEMBL21324097 | 0.61 | HTR2C (0.37) | — | |
| SCHEMBL20982448 | 0.60 | — | — | |
| SCHEMBL22474025 | 0.60 | L3MBTL1 (0.47) | — | |
| SCHEMBL21536857 | 0.60 | PGR (0.32) | — | |
| SCHEMBL29919959 | 0.60 | — | — |
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-116710450-A | Pyrrolo [3,2-b ] pyridine derivatives for the treatment of cGAS-related disorders | 诺华股份有限公司 | 2023-09-05 | — | — | CN | claimed |
| CN-116710450-A | Pyrrolo [3,2-b ] pyridine derivatives for the treatment of cGAS-related disorders | 诺华股份有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-110382492-B | Microbiocidal oxadiazole derivatives | 先正达参股股份有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-112689631-A | Microbicidal oxadiazole derivatives | 先正达农作物保护股份公司 | 2021-04-20 | — | — | CN | disclosed |
| CN-110799035-A | Fungicidal compositions | 先正达参股股份有限公司 | 2020-02-14 | — | — | CN | disclosed |