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 | |
|---|---|---|---|---|
| Dimethyl Sulfoxide SCHEMBL1128520 | 0.96 | — | — | |
| Dimethyl Sulfoxide SCHEMBL8608347 | 0.96 | — | — | |
| Dimethyl Sulfoxide SCHEMBL9236588 | 0.93 | — | — | |
| Water SCHEMBL11589729 | 0.80 | ALDH1A1 (0.36) | — | |
| Water SCHEMBL104604 | 0.80 | — | — | |
| Water SCHEMBL27670879 | 0.80 | ALDH1A1 (0.36) | — | |
| Water SCHEMBL812317 | 0.80 | ALDH1A1 (0.36) | — | |
| Water SCHEMBL812316 | 0.80 | ALDH1A1 (0.36) | — | |
| Water SCHEMBL20920097 | 0.80 | ALDH1A1 (0.36) | — | |
| Water SCHEMBL8935536 | 0.80 | ALDH1A1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050123932-A1 | Nucleic acid-chelating agent conjugates | KIRKEGAARD & PERRY LABORATORIES, INC. | 2005-06-09 | — | — | US | disclosed |