⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19841884 | 1.00 | — | — | |
| SCHEMBL17264865 | 1.00 | — | — | |
| SCHEMBL14337285 | 0.80 | GRIN2D (0.52) | — | |
| SCHEMBL28456786 | 0.80 | GRIN2D (0.52) | — | |
| SCHEMBL20915092 | 0.80 | GRIN2D (0.67) | — | |
| SCHEMBL20915093 | 0.80 | GRIN2D (0.67) | — | |
| SCHEMBL14671557 | 0.78 | — | — | |
| SCHEMBL2446383 | 0.78 | — | — | |
| SCHEMBL2919114 | 0.78 | — | — | |
| SCHEMBL11820120 | 0.76 | — | — |
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-0719796-A1 | Curable crosslinking system with monobenzaldimine as crosslinker | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1996-07-03 | — | — | EP | disclosed |