⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7811004 | 0.80 | — | — | |
| SCHEMBL6805109 | 0.76 | — | — | |
| SCHEMBL14498125 | 0.75 | GABRA1 (0.37) | — | |
| SCHEMBL4249004 | 0.74 | — | — | |
| SCHEMBL9798315 | 0.74 | — | — | |
| SCHEMBL11859041 | 0.74 | — | — | |
| SCHEMBL132375 | 0.74 | — | — | |
| SCHEMBL10333955 | 0.72 | — | — | |
| SCHEMBL129408 | 0.69 | — | — | |
| SCHEMBL827534 | 0.69 | SKP2 (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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024120505-A1 | FUSED RING DERIVATIVE, PREPARATION METHOD THEREFOR, INTERMEDIATES THEREOF, AND USE THEREOF | 上海枢境生物科技有限公司 | 2024-06-13 | — | — | WO | disclosed |
| US-20240190888-A1 | SPIRO-CONTAINING DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | SHUJING BIOPHARMA CO., LTD (CN) | 2024-06-13 | — | — | US | disclosed |
| EP-4317164-A1 | SPIRO-CONTAINING DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | Shujing Biopharma Co., Ltd (CN) | 2024-02-07 | — | — | EP | disclosed |
| CN-116987095-A | Spiro-containing derivative, preparation method and application thereof | 上海枢境生物科技有限公司 | 2023-11-03 | — | — | CN | disclosed |
| CN-116057060-B | Spiro-containing derivative, preparation method and application thereof | 上海枢境生物科技有限公司 | 2023-08-29 | — | — | CN | disclosed |
| CN-116057060-A | Spiro-containing derivative, preparation method and application thereof | 上海枢境生物科技有限公司 | 2023-05-02 | — | — | CN | disclosed |
| WO-2022206706-A1 | SPIRO-CONTAINING DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海枢境生物科技有限公司 | 2022-10-06 | — | — | WO | disclosed |
| US-7491735-B2 | Chemokine receptor binding compounds | GENZYME CORPORATION (US) | 2009-02-17 | — | — | US | disclosed |
| EP-1708703-A4 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC (CA) | 2008-04-09 | — | — | EP | disclosed |
| EP-1708703-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC. (CA) | 2006-10-11 | — | — | EP | disclosed |
| US-20050277670-A1 | Chemokine receptor binding compounds | ANORMED INC. | 2005-12-15 | — | — | US | disclosed |
| WO-2005059107-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC. (CA) | 2005-06-30 | — | — | WO | disclosed |