⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25930913 | 0.82 | — | — | |
| SCHEMBL25930912 | 0.81 | — | — | |
| SCHEMBL27372520 | 0.79 | — | — | |
| SCHEMBL25930945 | 0.74 | — | — | |
| SCHEMBL17051326 | 0.74 | MEN1 (0.32) | — | |
| SCHEMBL25930939 | 0.73 | — | — | |
| SCHEMBL27372519 | 0.71 | CA1 (0.33) | — | |
| SCHEMBL25930927 | 0.71 | — | — | |
| SCHEMBL25930975 | 0.71 | — | — | |
| SCHEMBL25920920 | 0.68 | SMN1; SMN2 (0.33) | — |
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-2024061804-A1 | AN ELECTROLUMINESCENT DEVICE COMPRISING AN ANODE LAYER, A CATHODE LAYER, A FIRST EMISSION LAYER, A HOLE INJECTION LAYER AND A FIRST HOLE TRANSPORT LAYER THAT COMPRISES A COMPOUND CONTAINING A METAL | NOVALED GMBH (DE) | 2024-03-28 | — | — | WO | disclosed |
| US-20230247896-A1 | Compound of Formula (I), a Semiconductor Material Comprising at Least One Compound of Formula (I), a Semiconductor Layer Comprising at Least One Compound of Formula (I) and an Electronic Device Comprising at Least One Compound of Formula (I) | NOVALED GMBH (DE) | 2023-08-03 | — | — | US | disclosed |