⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14552012 | 0.86 | MIF (0.44) | — | |
| SCHEMBL7093744 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL19195735 | 0.73 | RAB9A (0.38) | — | |
| SCHEMBL16934890 | 0.63 | — | — | |
| SCHEMBL16934865 | 0.63 | — | — | |
| SCHEMBL11848593 | 0.60 | — | — | |
| SCHEMBL18068993 | 0.58 | — | — | |
| SCHEMBL3275002 | 0.48 | PABPC1 (0.42) | — | |
| SCHEMBL491682 | 0.47 | — | — | |
| SCHEMBL25922 | 0.47 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6376728-B1 | OF ALKENYL MONOMERS | HERCULES INCORPORATED | 2002-04-23 | — | — | US | claimed |
| CN-118325078-A | Preparation method and application of benzoquinone conjugated polymer | 中国科学院宁波材料技术与工程研究所 | 2024-07-12 | — | — | CN | disclosed |
| US-6376728-B1 | OF ALKENYL MONOMERS | HERCULES INCORPORATED | 2002-04-23 | — | — | US | disclosed |