⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25537519 | 0.96 | MEN1 (0.32) | — | |
| SCHEMBL25537889 | 0.95 | ALDH1A1 (0.32) | — | |
| SCHEMBL25537187 | 0.95 | ALDH1A1 (0.32) | — | |
| SCHEMBL25536362 | 0.93 | MEN1 (0.34) | — | |
| SCHEMBL25537621 | 0.92 | MEN1 (0.32) | — | |
| SCHEMBL25536902 | 0.92 | MEN1 (0.33) | — | |
| SCHEMBL25537733 | 0.92 | MEN1 (0.33) | — | |
| SCHEMBL25537832 | 0.91 | MEN1 (0.33) | — | |
| SCHEMBL25536355 | 0.90 | MEN1 (0.35) | — | |
| SCHEMBL25537673 | 0.90 | ALDH1A1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230167072-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO.,LTD. (JP) | 2023-06-01 | — | — | US | disclosed |
| US-20230167072-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO.,LTD. (JP) | 2023-06-01 | — | — | US | disclosed |