⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15402182 | 0.69 | — | — | |
| Acetone SCHEMBL497758 | 0.65 | LMNA (0.55) | — | |
| Acetone SCHEMBL22409616 | 0.65 | — | — | |
| SCHEMBL26417 | 0.65 | — | — | |
| SCHEMBL9774940 | 0.64 | — | — | |
| SCHEMBL1136058 | 0.64 | — | — | |
| SCHEMBL1411870 | 0.64 | — | — | |
| SCHEMBL144134 | 0.62 | — | — | |
| SCHEMBL1388169 | 0.62 | — | — | |
| Acetic Acid SCHEMBL2420520 | 0.62 | — | — |
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-0882074-A1 | FORMALDEHYDE-FREE AQUEOUS BINDERS | BASF AKTIENGESELLSCHAFT (DE) | 1998-12-09 | — | — | EP | disclosed |
| WO-1997031036-A1 | FORMALDEHYDE-FREE AQUEOUS BINDERS | BASF AKTIENGESELLSCHAFT (DE) | 1997-08-28 | — | — | WO | disclosed |