⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9848008 | 0.90 | — | — | |
| SCHEMBL10594564 | 0.90 | — | — | |
| SCHEMBL10594561 | 0.88 | — | — | |
| SCHEMBL9420417 | 0.87 | — | — | |
| SCHEMBL9847948 | 0.81 | ALDH1A1 (0.34) | — | |
| SCHEMBL9723363 | 0.81 | — | — | |
| SCHEMBL9862104 | 0.79 | EPHX1 (0.31) | — | |
| SCHEMBL9723353 | 0.79 | — | — | |
| SCHEMBL10784669 | 0.78 | — | — | |
| SCHEMBL10497870 | 0.77 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0422229-A1 | ADHESIVE RESIN COMPOSITION, PREPARATION THEREOF, AND LAMINATE COMPRISING SAME | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1991-04-17 | — | — | EP | disclosed |