⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1026826 | 0.84 | PRCP (0.32) | — | |
| SCHEMBL7795187 | 0.81 | — | — | |
| SCHEMBL7790608 | 0.78 | — | — | |
| SCHEMBL7795056 | 0.73 | — | — | |
| SCHEMBL7790814 | 0.70 | — | — | |
| SCHEMBL7790722 | 0.70 | — | — | |
| SCHEMBL7790726 | 0.70 | — | — | |
| SCHEMBL217948 | 0.69 | BRD4 (0.32) | — | |
| SCHEMBL7794633 | 0.69 | HTR2A (0.31) | — | |
| SCHEMBL7794484 | 0.66 | HTR2A (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 |
|---|---|---|---|---|---|---|---|
| EP-1155698-A1 | ORGANOBORON COMPOUNDS EXHIBITING ANTICOCCIDIAL ACTIVITIES | Nitto Kasei Co., Ltd. (JP) | 2001-11-21 | — | — | EP | disclosed |