⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23949264 | 0.82 | — | — | |
| SCHEMBL23949274 | 0.79 | EIF4E (0.31) | — | |
| SCHEMBL25058665 | 0.77 | — | — | |
| SCHEMBL23949595 | 0.77 | KMT2A (0.36) | — | |
| SCHEMBL25567924 | 0.76 | — | — | |
| SCHEMBL30353071 | 0.76 | TBXAS1 (0.36) | — | |
| SCHEMBL25555318 | 0.75 | NSD2 (0.34) | — | |
| SCHEMBL25058671 | 0.74 | CACNA1B (0.33) | — | |
| SCHEMBL23949259 | 0.74 | NSD2 (0.31) | — | |
| SCHEMBL30257103 | 0.74 | NSD2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4137481-A1 | ARYL OR HETEROARYL DERIVATIVE | Teijin Pharma Limited (JP) | 2023-02-22 | — | — | EP | disclosed |
| WO-2021210650-A1 | ARYL OR HETEROARYL DERIVATIVE | 帝人ファーマ株式会社 | 2021-10-21 | — | — | WO | disclosed |