⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11611798 | 0.89 | — | — | |
| SCHEMBL28373347 | 0.87 | DPP7 (0.30) | — | |
| SCHEMBL960450 | 0.67 | OPRL1 (0.32) | — | |
| SCHEMBL8835598 | 0.66 | LMNA (0.34) | — | |
| SCHEMBL28954718 | 0.65 | — | — | |
| SCHEMBL16868377 | 0.65 | — | — | |
| SCHEMBL8763503 | 0.64 | OPRL1 (0.31) | — | |
| SCHEMBL29182204 | 0.64 | — | — | |
| SCHEMBL7037240 | 0.62 | GRIN2D (0.35) | — | |
| SCHEMBL21798657 | 0.61 | — | — |
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-1951781-B1 | SOLVENT RESISTANT POLYURETHANE ADHESIVE COMPOSITIONS | MOMENTIVE PERFORMANCE MAT INC (US) | 2010-04-07 | — | — | EP | disclosed |