⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29763539 | 0.83 | LPL (0.33) | — | |
| SCHEMBL24024506 | 0.78 | LPL (0.32) | — | |
| SCHEMBL22787320 | 0.69 | KIF11 (0.38) | — | |
| SCHEMBL28974108 | 0.69 | KEAP1 (0.39) | — | |
| SCHEMBL15829264 | 0.67 | DAO (0.49) | — | |
| SCHEMBL23043788 | 0.67 | CYP2A6 (0.44) | — | |
| SCHEMBL31636019 | 0.66 | LPL (0.42) | — | |
| SCHEMBL632831 | 0.66 | EGFR (0.31) | — | |
| SCHEMBL20730433 | 0.65 | LPL (0.35) | — | |
| SCHEMBL15191512 | 0.65 | LPL (0.40) | — |
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-4288424-A1 | NOVEL HETEROARYL-SUBSTITUTED IMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2023-12-13 | — | — | EP | disclosed |
| WO-2022167631-A1 | NOVEL HETEROARYL-SUBSTITUTED IMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2022-08-11 | — | — | WO | disclosed |