⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14188516 | 0.82 | — | — | |
| SCHEMBL27863869 | 0.79 | SLC22A6 (0.35) | — | |
| SCHEMBL27863840 | 0.79 | SLC22A6 (0.35) | — | |
| SCHEMBL27587419 | 0.77 | — | — | |
| SCHEMBL27587388 | 0.77 | — | — | |
| SCHEMBL27515225 | 0.77 | — | — | |
| SCHEMBL4112703 | 0.75 | — | — | |
| 3-Hydroxybutyric Acid, (+/-)- SCHEMBL28276615 | 0.75 | SLC22A6 (0.43) | — | |
| SCHEMBL19402798 | 0.74 | — | — | |
| SCHEMBL12569640 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101056871-A | Novel anthranilamide pyridinureas as vegf receptor kinase inhibitors | BAYER SCHERING PHARMA AG (DE) | 2007-10-17 | — | — | CN | disclosed |