⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6263760 | 0.89 | LPL (0.32) | — | |
| SCHEMBL5503898 | 0.85 | MEN1 (0.35) | — | |
| SCHEMBL5497988 | 0.84 | — | — | |
| SCHEMBL5499782 | 0.84 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL5502649 | 0.83 | MEN1 (0.31) | — | |
| SCHEMBL5502525 | 0.81 | — | — | |
| SCHEMBL5498910 | 0.81 | — | — | |
| SCHEMBL5498599 | 0.80 | PDK2 (0.32) | — | |
| SCHEMBL5502475 | 0.80 | CA1 (0.31) | — | |
| SCHEMBL5499520 | 0.76 | LIPG (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7057009-B2 | Crosslinking polyfluorene; molecular orientation | UNIVERSITY OF ROCHESTER (US) | 2006-06-06 | — | — | US | disclosed |