⚠ 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 | |
|---|---|---|---|---|
| Urea SCHEMBL886861 | 0.85 | ALDH1A1 (0.30) | — | |
| SCHEMBL2227195 | 0.83 | — | — | |
| Carbamic Acid SCHEMBL27869277 | 0.83 | ACHE (0.33) | — | |
| Acetamide SCHEMBL10980986 | 0.81 | LMNA (0.36) | — | |
| Bicarbonate SCHEMBL2130736 | 0.78 | — | — | |
| SCHEMBL9421394 | 0.78 | — | — | |
| Acetic Acid SCHEMBL11041411 | 0.76 | — | — | |
| SCHEMBL9066069 | 0.76 | — | — | |
| Acrylamide SCHEMBL9196186 | 0.76 | ALDH1A1 (0.44) | — | |
| SCHEMBL18528932 | 0.76 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5085858-A | Thioglycolamide-functional siloxanes | DOW CORNING CORPORATION (US) | 1992-02-04 | — | — | US | disclosed |
| US-5068378-A | THIOGLYCOLAMIDE-FUNCTIONAL SILOXANES | DOW CORNING CORPORATION (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0437099-A1 | Thioglycolamide-functional siloxanes | DOW CORNING CORPORATION (US) | 1991-07-17 | — | — | EP | disclosed |