⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13380993 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL12546064 | 0.76 | — | — | |
| SCHEMBL13381100 | 0.74 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL17765481 | 0.73 | — | — | |
| SCHEMBL1665005 | 0.73 | — | — | |
| SCHEMBL172377 | 0.73 | — | — | |
| SCHEMBL18912694 | 0.73 | — | — | |
| SCHEMBL13201276 | 0.73 | — | — | |
| SCHEMBL17765482 | 0.73 | — | — | |
| SCHEMBL13381149 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100081693-A1 | THIADIAZOLE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-04-01 | — | — | US | disclosed |
| US-20100081693-A1 | THIADIAZOLE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-04-01 | — | — | US | disclosed |
| EP-0353670-B1 | PROCESS FOR THE PREPARATION OF CYCLIC VINYLENE-1,2-DIOXY COMPOUNDS WITH CHAINS OF 6 TO 8 CARBON ATOMS | BASF Aktiengesellschaft (DE) | 1993-09-29 | — | — | EP | disclosed |
| US-5003089-A | Preparation of cyclic 6-membered to 8-membered vinylene-1,2-dioxy compounds | BASF AKTIENGESELLSCHAFT (DE) | 1991-03-26 | — | — | US | disclosed |
| EP-0353670-A1 | Process for the preparation of cyclic vinylene-1,2-dioxy compounds with chains of 6 to 8 carbon atoms | BASF Aktiengesellschaft (DE) | 1990-02-07 | — | — | EP | disclosed |