⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11124966 | 0.76 | — | — | |
| SCHEMBL13790538 | 0.69 | — | — | |
| SCHEMBL8005721 | 0.69 | — | — | |
| SCHEMBL18998305 | 0.69 | — | — | |
| SCHEMBL1930459 | 0.67 | — | — | |
| SCHEMBL19987666 | 0.67 | — | — | |
| SCHEMBL14944918 | 0.67 | — | — | |
| SCHEMBL19057711 | 0.67 | — | — | |
| SCHEMBL1930457 | 0.67 | — | — | |
| SCHEMBL28327894 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1448517-A4 | METHOD OF PREPARING 4-CHLORO-3-METHYL-2-BUTENYLPHENYL SULFIDE, DI(4-CHLORO-3-METHYL-2-BUTENYL)SULFIDE AND DI(4-CHLORO-3-METHYL-2-BUTENYL)SULFONE FOR SYNTHESIS OF NATURAL CAROTENOID PRODUCTS | SK CORP (KR) | 2006-03-15 | — | — | EP | disclosed |
| EP-1448517-A1 | METHOD OF PREPARING 4-CHLORO-3-METHYL-2-BUTENYLPHENYL SULFIDE, DI(4-CHLORO-3-METHYL-2-BUTENYL)SULFIDE AND DI(4-CHLORO-3-METHYL-2-BUTENYL)SULFONE FOR SYNTHESIS OF NATURAL CAROTENOID PRODUCTS | SK Corporation (KR) | 2004-08-25 | — | — | EP | disclosed |
| WO-2003037854-A1 | METHOD OF PREPARING 4-CHLORO-3-METHYL-2-BUTENYLPHENYL SULFIDE, DI(4-CHLORO-3-METHYL-2-BUTENYL)SULFIDE AND DI(4-CHLORO-3-METHYL-2-BUTENYL)SULFONE FOR SYNTHESIS OF NATURAL CAROTENOID PRODUCTS | SK CORPORATION (KR) | 2003-05-08 | — | — | WO | disclosed |