⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20066942 | 0.84 | — | — | |
| SCHEMBL20066894 | 0.84 | — | — | |
| SCHEMBL20066772 | 0.84 | CYP1A2 (0.33) | — | |
| SCHEMBL20066774 | 0.81 | PDK2 (0.32) | — | |
| SCHEMBL20066672 | 0.80 | — | — | |
| SCHEMBL20066784 | 0.75 | SLC6A2 (0.32) | — | |
| SCHEMBL20066922 | 0.75 | — | — | |
| SCHEMBL20066928 | 0.74 | — | — | |
| SCHEMBL20066892 | 0.74 | KDM4E (0.30) | — | |
| SCHEMBL20066777 | 0.74 | ALDH1A1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10907093-B2 | Condensed cyclic compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-02-02 | — | — | US | disclosed |
| US-20180105741-A1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-04-19 | — | — | US | disclosed |
| US-20180105741-A1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-04-19 | — | — | US | disclosed |