⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3780189 | 0.91 | PTPRF (0.30) | — | |
| SCHEMBL3778088 | 0.87 | IDO1 (0.30) | — | |
| SCHEMBL3778138 | 0.85 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL3789251 | 0.85 | CYP1A2 (0.32) | — | |
| SCHEMBL3773561 | 0.85 | FAAH (0.31) | — | |
| SCHEMBL3780305 | 0.82 | GAA (0.35) | — | |
| SCHEMBL3784009 | 0.81 | PTPRF (0.32) | — | |
| SCHEMBL3772967 | 0.77 | RIPK1 (0.31) | — | |
| SCHEMBL3781698 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL3778500 | 0.76 | SMN1; SMN2 (0.33) | — |
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-20100152463-A1 | Methods for Preparing Fluoroalkyl Arylsulfinyl Compounds and Fluorinated Compounds Thereto | IM&T RESEARCH, INC. (US) | 2010-06-17 | — | — | US | claimed |