⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27963882 | 0.79 | — | — | |
| SCHEMBL5491673 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL2371366 | 0.77 | CYP4F2 (0.44) | — | |
| SCHEMBL27345989 | 0.77 | CYP4F2 (0.44) | — | |
| SCHEMBL1979744 | 0.76 | ALDH1A1 (0.48) | — | |
| SCHEMBL8360055 | 0.76 | — | — | |
| SCHEMBL122175 | 0.76 | — | — | |
| SCHEMBL8945034 | 0.76 | ALDH1A1 (0.48) | — | |
| SCHEMBL6761656 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL5482996 | 0.75 | MGAM (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1069661-C | Process for the preparation of polyesters and copolyesters | AKZO NOBEL COMPANY (NL) | 2001-08-15 | — | — | CN | disclosed |
| CN-1124257-A | Process for the preparation of polyesters and copolyesters | AKZO NOBEL COMPANY (NL) | 1996-06-12 | — | — | CN | disclosed |