⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25267752 | 1.00 | — | — | |
| SCHEMBL25268330 | 0.79 | ALDH1A1 (0.30) | — | |
| SCHEMBL25217492 | 0.79 | ALDH1A1 (0.30) | — | |
| SCHEMBL25607336 | 0.75 | CYP1A2 (0.36) | — | |
| SCHEMBL25252963 | 0.69 | — | — | |
| SCHEMBL25607335 | 0.68 | — | — | |
| SCHEMBL23819354 | 0.66 | — | — | |
| SCHEMBL1656333 | 0.64 | — | — | |
| SCHEMBL8947247 | 0.60 | CNR2 (0.32) | — | |
| SCHEMBL21366056 | 0.58 | NPSR1 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115427412-B | Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2024-02-20 | — | — | CN | disclosed |
| US-20230271969-A1 | NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) | 2023-08-31 | — | — | US | disclosed |
| EP-4190784-A1 | NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | Shanghai Hansoh Biomedical Co., Ltd. (CN) | 2023-06-07 | — | — | EP | disclosed |
| CN-115427412-A | Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-12-02 | — | — | CN | disclosed |
| US-20170133601-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-05-11 | — | — | US | disclosed |