⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15933505 | 0.80 | — | — | |
| SCHEMBL15858548 | 0.78 | — | — | |
| SCHEMBL17231834 | 0.72 | DDR1 (0.30) | — | |
| SCHEMBL17231833 | 0.71 | — | — | |
| SCHEMBL15858539 | 0.67 | SGMS2 (0.31) | — | |
| SCHEMBL29431577 | 0.66 | UTRN (0.39) | — | |
| SCHEMBL15847433 | 0.66 | UTRN (0.39) | — | |
| SCHEMBL15858523 | 0.66 | SGMS2 (0.30) | — | |
| SCHEMBL17901850 | 0.64 | — | — | |
| SCHEMBL18819819 | 0.62 | S1PR1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014104407-A1 | FUSED OXAZOLE COMPOUNDS AND USE THEREOF FOR PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-07-03 | — | — | WO | disclosed |