⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6862150 | 1.00 | — | — | |
| SCHEMBL6862145 | 1.00 | — | — | |
| SCHEMBL8008883 | 0.90 | AKR1C4 (0.32) | — | |
| SCHEMBL8008885 | 0.90 | AKR1C4 (0.32) | — | |
| SCHEMBL7720948 | 0.90 | AKR1C4 (0.32) | — | |
| SCHEMBL7720944 | 0.90 | AKR1C4 (0.32) | — | |
| SCHEMBL7717286 | 0.85 | — | — | |
| SCHEMBL7718607 | 0.78 | — | — | |
| SCHEMBL20691407 | 0.76 | NLRP3 (0.37) | — | |
| SCHEMBL6865571 | 0.75 | NLRP3 (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0999204-B1 | NOVEL COMPOUND HAVING EFFECT OF PROMOTING NEURON DIFFERENTIATION | NIPPON KAYAKU KK (JP) | 2004-10-13 | — | — | EP | disclosed |
| US-6384063-B1 | Compound having effect of promoting neuron differentiation | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2002-05-07 | — | — | US | disclosed |
| EP-0999204-A1 | NOVEL COMPOUND HAVING EFFECT OF PROMOTING NEURON DIFFERENTIATION | Nippon Kayaku Kabushiki Kaisha (JP) | 2000-05-10 | — | — | EP | disclosed |