⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9465823 | 0.67 | — | — | |
| SCHEMBL28185064 | 0.65 | MEN1 (0.30) | — | |
| SCHEMBL823000 | 0.65 | — | — | |
| SCHEMBL5427776 | 0.65 | — | — | |
| SCHEMBL119150 | 0.64 | — | — | |
| SCHEMBL12956161 | 0.64 | — | — | |
| SCHEMBL16180650 | 0.63 | ALDH1A1 (0.38) | — | |
| SCHEMBL9284273 | 0.63 | — | — | |
| SCHEMBL20483089 | 0.63 | — | — | |
| SCHEMBL16294338 | 0.63 | — | — |
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-112752757-B | Tyrosine amide derivatives as RHO-kinase inhibitors | 奇斯药制品公司 | 2024-01-12 | — | — | CN | disclosed |
| US-20210284639-A1 | TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS | CHIESI FARMACEUTICI S.P.A. (IT) | 2021-09-16 | — | — | US | disclosed |
| CN-112752757-A | Tyrosine amide derivatives as RHO-kinase inhibitors | 奇斯药制品公司 | 2021-05-04 | — | — | CN | disclosed |