⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4308456 | 0.61 | — | — | |
| SCHEMBL8584060 | 0.61 | — | — | |
| Hydrogen Sulfide SCHEMBL27783712 | 0.59 | — | — | |
| Methane SCHEMBL27548554 | 0.57 | — | — | |
| Methane SCHEMBL27462110 | 0.57 | — | — | |
| SCHEMBL11825398 | 0.56 | — | — | |
| SCHEMBL1141552 | 0.56 | — | — | |
| SCHEMBL10598609 | 0.55 | — | — | |
| SCHEMBL7116041 | 0.55 | — | — | |
| SCHEMBL28168474 | 0.55 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001032645-A1 | THE SYNTHESIS OF EXTENDED BIS(ETHYLENEDITHIO)TETRATHIAFULVALENE DERIVATIVES AND THEIR DIHYDROXYL ANALOGUES | TUBITAK-MARMARA RESEARCH CENTER (TR) | 2001-05-10 | — | — | WO | disclosed |