⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11783367 | 0.54 | GRIN2D (0.40) | — | |
| SCHEMBL110031 | 0.54 | MCL1 (0.38) | — | |
| SCHEMBL722089 | 0.52 | — | — | |
| SCHEMBL8520516 | 0.52 | MCL1 (0.36) | — | |
| SCHEMBL6302567 | 0.52 | CYP2A6 (0.57) | — | |
| SCHEMBL11548810 | 0.50 | GSK3B (0.43) | — | |
| SCHEMBL9238549 | 0.50 | CA1 (0.41) | — | |
| SCHEMBL26856 | 0.49 | ALDH1A1 (0.58) | — | |
| SCHEMBL3082401 | 0.49 | ALDH1A1 (0.58) | — | |
| SCHEMBL10426602 | 0.49 | — | — |
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-8143465-B2 | Soluble branched triaroylbenzene-based polymer and its synthetic method | THE HONG KONG UNIVERSITY OF SCIENCE & TECHNOLOGY (CN) | 2012-03-27 | — | — | US | disclosed |
| US-20060247410-A1 | Soluble branched triaroylbenzene-based polymer and its synthetic method | HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY, THE (HK) | 2006-11-02 | — | — | US | disclosed |