Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dimethyl Sulfoxide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL576116 | 0.83 | — | — | |
| SCHEMBL4070308 | 0.69 | TSHR (0.38) | — | |
| SCHEMBL4078589 | 0.62 | — | — | |
| SCHEMBL575916 | 0.59 | — | — | |
| SCHEMBL14974724 | 0.59 | — | — | |
| SCHEMBL11979692 | 0.59 | — | — | |
| SCHEMBL3894372 | 0.58 | — | — | |
| Dimethyl Sulfoxide SCHEMBL7302923 | 0.57 | — | — | |
| Dimethyl Sulfoxide SCHEMBL5505832 | 0.57 | — | — | |
| Dimethyl Sulfoxide SCHEMBL2856303 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110891958-A | Boron lithium fluorophosphate complex, composition containing boron lithium fluorophosphate, additive for lithium secondary battery, nonaqueous electrolyte for battery, and lithium secondary battery | 三井化学株式会社 | 2020-03-17 | — | — | CN | disclosed |