⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2925945 | 0.94 | — | — | |
| SCHEMBL35001 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL19332652 | 0.88 | — | — | |
| Methyl Alcohol SCHEMBL9418859 | 0.88 | — | — | |
| SCHEMBL27519369 | 0.88 | — | — | |
| Ethylene SCHEMBL9273239 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL2426351 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL2719617 | 0.88 | — | — | |
| SCHEMBL8593374 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL28594736 | 0.82 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0537840-B1 | Lubricating compositions containing overbased alkaline earth metal salts of a hydroxyalkyl sulphonic acid | SHELL INT RESEARCH (NL) | 1996-07-17 | — | — | EP | disclosed |
| EP-0537840-A1 | Lubricating compositions containing overbased alkaline earth metal salts of a hydroxyalkyl sulphonic acid | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-04-21 | — | — | EP | disclosed |