⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22480321 | 0.74 | — | — | |
| SCHEMBL18403049 | 0.74 | — | — | |
| SCHEMBL27583198 | 0.74 | — | — | |
| SCHEMBL19914048 | 0.74 | — | — | |
| SCHEMBL26805026 | 0.74 | — | — | |
| SCHEMBL22252418 | 0.72 | — | — | |
| SCHEMBL26021622 | 0.72 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL13854556 | 0.72 | — | — | |
| SCHEMBL18520404 | 0.71 | — | — | |
| SCHEMBL23375766 | 0.70 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021143821-A1 | FUSED HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2021-07-22 | — | — | WO | disclosed |
| WO-2017023941-A1 | BENZAZOLE COMPOUNDS AND METHODS FOR MAKING AND USING THE COMPOUNDS | RIGEL PHARMACEUTICALS, INC. (US) | 2017-02-09 | — | — | WO | disclosed |