⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL1405842 | 0.90 | — | — | |
| SCHEMBL251442 | 0.89 | ALDH1A1 (0.33) | — | |
| SCHEMBL1154 | 0.89 | — | — | |
| Bicarbonate SCHEMBL8455166 | 0.88 | ALDH1A1 (0.50) | — | |
| Benzene SCHEMBL7961361 | 0.86 | CA2 (0.44) | — | |
| Methyl Alcohol SCHEMBL2405349 | 0.86 | — | — | |
| Acetic Acid SCHEMBL7261899 | 0.84 | FFAR3 (0.50) | — | |
| Acetic Acid SCHEMBL774951 | 0.84 | FFAR3 (0.50) | — | |
| SCHEMBL15674477 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7542079 | 0.84 | TSHR (0.32) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0941261-B1 | COMPOSITION | NAT STARCH CHEM LTD (GB) | 2005-05-25 | — | — | EP | disclosed |
| EP-0941261-A1 | COMPOSITION | National Starch and Chemical Limited (GB) | 1999-09-15 | — | — | EP | disclosed |
| WO-1998023658-A1 | COMPOSITION | NATIONAL STARCH AND CHEMICAL LIMITED (GB) | 1998-06-04 | — | — | WO | disclosed |
| EP-0627475-B1 | Aerated anaerobic compositions with enhanced bulk stability | LOCTITE IRELAND LTD (IE) | 1998-03-25 | — | — | EP | disclosed |
| US-5567741-A | STORAGE STABLE FOAM | LOCTITE (IRELAND) LIMITED (IE) | 1996-10-22 | — | — | US | disclosed |
| EP-0627475-A1 | Aerated anaerobic compositions with enhanced bulk stability | LOCTITE (IRELAND) LIMITED (IE) | 1994-12-07 | — | — | EP | disclosed |
| US-4138449-A | Anaerobic curing compositions | BALDWIN TERENCE R | 1979-02-06 | — | — | US | disclosed |