⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15413509 | 0.72 | — | — | |
| SCHEMBL1824607 | 0.72 | — | — | |
| SCHEMBL6028257 | 0.71 | — | — | |
| SCHEMBL15641921 | 0.70 | — | — | |
| SCHEMBL17223147 | 0.69 | THRB (0.30) | — | |
| SCHEMBL5350698 | 0.68 | LMNA (0.43) | — | |
| SCHEMBL7180894 | 0.68 | LMNA (0.43) | — | |
| SCHEMBL10618503 | 0.68 | LMNA (0.43) | — | |
| SCHEMBL15641966 | 0.67 | — | — | |
| SCHEMBL5684922 | 0.65 | LMNA (0.38) | — |
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-20060263886-A1 | Fluorous labeling for selective processing of biologically-derived samples | PETERS ERIC | 2006-11-23 | — | — | US | disclosed |
| EP-1687643-A1 | FLUOROUS LABELING FOR SELECTIVE PROCESSING OF BIOLOGICALLY-DERIVED SAMPLES | IRM, LLC (BM) | 2006-08-09 | — | — | EP | disclosed |
| WO-2005050226-A1 | FLUOROUS LABELING FOR SELECTIVE PROCESSING OF BIOLOGICALLY-DERIVED SAMPLES | IRM LLC (BM) | 2005-06-02 | — | — | WO | disclosed |