⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7934148 | 0.72 | TSHR (0.39) | — | |
| SCHEMBL3525406 | 0.72 | TSHR (0.34) | — | |
| SCHEMBL1024697 | 0.67 | F2 (0.43) | — | |
| SCHEMBL20302244 | 0.66 | — | — | |
| SCHEMBL3566978 | 0.66 | — | — | |
| SCHEMBL25246892 | 0.66 | F2 (0.38) | — | |
| SCHEMBL7003234 | 0.66 | F2 (0.42) | — | |
| SCHEMBL25080938 | 0.64 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL9193008 | 0.61 | CYP2A6 (0.50) | — | |
| SCHEMBL25081002 | 0.61 | TDP1 (0.33) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5266703-A | Optically active isoxazole derivatives | DAISO CO., LTD. (JP) | 1993-11-30 | — | — | US | disclosed |
| US-5220074-A | Optically active isoxazole derivatives and intermediates for preparation thereof as well as processes for producing the same | DAISO CO., LTD. (JP) | 1993-06-15 | — | — | US | disclosed |
| US-5210201-A | Optically active isoxazole derivatives and intermediates for preparation thereof as well as processes for producing the same | DAISO CO., LTD. (JP) | 1993-05-11 | — | — | US | disclosed |
| US-5198588-A | OPTICALLY ACTIVE ISOXAZOLE DERIVATIVES AND INTERMEDIATES FOR PREPARATION THEREOF | DAISO CO., LTD. (JP) | 1993-03-30 | — | — | US | disclosed |
| EP-0439129-A2 | Optically active isoxazole derivatives and intermediates for preparation thereof as well as processes for producing the same | Daiso Co., Ltd. (JP) | 1991-07-31 | — | — | EP | disclosed |
| EP-0034778-B1 | HETERO-IMINO-PROSTACYCLINS AND PROCESS FOR THEIR PREPARATION | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-04-25 | — | — | EP | disclosed |
| US-4371542-A | Hetero-imino-prostacyclins | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-02-01 | — | — | US | disclosed |
| EP-0034778-A1 | Hetero-imino-prostacyclins and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-09-02 | — | — | EP | disclosed |
| EP-0019069-A2 | 6-Keto PGE1 compounds, their preparation and therapeutic application, PGI1 compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-11-26 | — | — | EP | disclosed |