⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3767412 | 0.72 | — | — | |
| SCHEMBL1521651 | 0.65 | — | — | |
| SCHEMBL5427530 | 0.41 | — | — | |
| SCHEMBL6559802 | 0.41 | — | — | |
| SCHEMBL10484416 | 0.41 | — | — | |
| SCHEMBL29889134 | 0.41 | — | — | |
| Hydrogen Sulfide SCHEMBL21192751 | 0.41 | — | — | |
| Fluoride Ion SCHEMBL73611 | 0.29 | — | — | |
| SCHEMBL1629906 | 0.29 | — | — | |
| SCHEMBL74539 | 0.29 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2014646-A2 | Oxopentafluorosulfanyl-substituted alicyclic compounds | Air Products and Chemicals, Inc. (US) | 2009-01-14 | — | — | EP | disclosed |
| US-20080312464-A1 | Oxopentafluorosulfanyl-Substituted Alicyclic Compounds | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2008-12-18 | — | — | US | disclosed |
| EP-0155551-B1 | METHOD FOR THE PARTIAL HYDROGENATION OF CONJUGATED DIENES | MITSUBISHI KASEI CORPORATION (JP) | 1988-07-06 | — | — | EP | disclosed |
| US-4590319-A | USING AS CATALYST A COBALT COMPOUND, ORGANOPHOSPHINE COMPOUND, AND ALUMINUM COMPOUND | MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) | 1986-05-20 | — | — | US | disclosed |
| EP-0155551-A1 | Method for the partial hydrogenation of conjugated dienes | MITSUBISHI KASEI CORPORATION (JP) | 1985-09-25 | — | — | EP | disclosed |