⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7939273 | 0.92 | — | — | |
| SCHEMBL14691431 | 0.79 | ZDHHC7 (0.33) | — | |
| Acetic Acid SCHEMBL30711098 | 0.78 | RARB (0.42) | — | |
| Acetic Acid SCHEMBL30711138 | 0.78 | RARB (0.42) | — | |
| Acetic Acid SCHEMBL30711091 | 0.78 | RARB (0.42) | — | |
| Acetic Acid SCHEMBL31374665 | 0.78 | RARB (0.42) | — | |
| SCHEMBL31374667 | 0.77 | LMNA (0.43) | — | |
| SCHEMBL3045426 | 0.77 | LMNA (0.43) | — | |
| SCHEMBL31374673 | 0.77 | LMNA (0.43) | — | |
| SCHEMBL19599495 | 0.77 | LMNA (0.43) | — |
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-1082610-A1 | METHOD FOR MARKING LIQUIDS WITH AT LEAST TWO MARKER SUBSTANCES AND METHOD FOR DETECTING THEM | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999056125-A1 | METHOD FOR MARKING LIQUIDS WITH AT LEAST TWO MARKER SUBSTANCES AND METHOD FOR DETECTING THEM | BASF AKTIENGESELLSCHAFT (DE) | 1999-11-04 | — | — | WO | disclosed |