⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11292064 | 0.87 | — | — | |
| SCHEMBL8086621 | 0.82 | — | — | |
| SCHEMBL8078647 | 0.82 | DRD2 (0.32) | — | |
| SCHEMBL3205466 | 0.81 | — | — | |
| SCHEMBL8089987 | 0.81 | DRD2 (0.32) | — | |
| SCHEMBL11001022 | 0.78 | EIF2AK1 (0.34) | — | |
| SCHEMBL3160065 | 0.77 | DRD2 (0.33) | — | |
| SCHEMBL1615172 | 0.76 | DRD2 (0.35) | — | |
| SCHEMBL425781 | 0.76 | ALDH1A1 (0.32) | — | |
| SCHEMBL150109 | 0.76 | AHR (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6054501-A | CURABILITY; GLOSSINESS; CAN BE BLENDED WITH INKS, PAINTS | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2000-04-25 | — | — | US | disclosed |
| EP-0844255-A1 | PHOTOPOLYMERIZATION INITIATOR AND ACTINIC RADIATION-CURABLE COMPOSITION COMPRISING THE SAME | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1998-05-27 | — | — | EP | disclosed |