⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3483646 | 0.84 | DRD2 (0.35) | — | |
| SCHEMBL37311 | 0.81 | MEN1 (0.33) | — | |
| SCHEMBL1041155 | 0.78 | DRD1 (0.35) | — | |
| SCHEMBL1042696 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL8527810 | 0.78 | NPC1 (0.34) | — | |
| SCHEMBL9637292 | 0.77 | ELANE (0.31) | — | |
| SCHEMBL1039525 | 0.77 | TUBB4A (0.38) | — | |
| SCHEMBL11062584 | 0.76 | — | — | |
| SCHEMBL1042695 | 0.76 | DRD1 (0.38) | — | |
| SCHEMBL8086621 | 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 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 |