⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13023376 | 0.88 | P2RX4 (0.35) | — | |
| SCHEMBL13023793 | 0.87 | CYP17A1 (0.30) | — | |
| SCHEMBL13023785 | 0.85 | ALDH1A1 (0.30) | — | |
| SCHEMBL13023689 | 0.84 | P2RX4 (0.30) | — | |
| SCHEMBL13023786 | 0.81 | GRM1 (0.34) | — | |
| SCHEMBL13023791 | 0.80 | — | — | |
| SCHEMBL13023788 | 0.80 | ALDH1A1 (0.35) | — | |
| SCHEMBL13023710 | 0.80 | ALDH1A1 (0.31) | — | |
| SCHEMBL13023884 | 0.79 | — | — | |
| SCHEMBL13023792 | 0.79 | — | — |
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-20100286360-A1 | POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-11-11 | — | — | US | disclosed |
| US-20100286360-A1 | POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-11-11 | — | — | US | disclosed |