⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30107700 | 0.95 | ALDH1A1 (0.31) | — | |
| SCHEMBL16216575 | 0.95 | ALDH1A1 (0.31) | — | |
| SCHEMBL16216404 | 0.94 | SIGMAR1 (0.30) | — | |
| SCHEMBL31355616 | 0.94 | SIGMAR1 (0.30) | — | |
| SCHEMBL24425456 | 0.92 | — | — | |
| SCHEMBL24425459 | 0.91 | — | — | |
| SCHEMBL24767073 | 0.90 | ERBB2 (0.32) | — | |
| SCHEMBL17676654 | 0.88 | PRSS1 (0.31) | — | |
| SCHEMBL16216366 | 0.87 | — | — | |
| SCHEMBL16216352 | 0.87 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230023811-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO.,LTD. (JP) | 2023-01-26 | — | — | US | disclosed |
| US-20210217963-A1 | ORGANIC LIGHT-EMITTING DEVICE | LG CHEM, LTD. (KR) | 2021-07-15 | — | — | US | disclosed |
| US-20190214571-A1 | ORGANIC LIGHT EMITTING DEVICE | LG CHEM, LTD. (KR) | 2019-07-11 | — | — | US | disclosed |