⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8553788 | 0.65 | CA1 (0.46) | — | |
| SCHEMBL8553780 | 0.64 | NPC1 (0.36) | — | |
| SCHEMBL8603712 | 0.63 | NR1I2 (0.37) | — | |
| SCHEMBL8551826 | 0.63 | FFAR4 (0.44) | — | |
| SCHEMBL8604570 | 0.63 | HDAC6 (0.38) | — | |
| SCHEMBL9088019 | 0.63 | NPC1 (0.31) | — | |
| SCHEMBL22911187 | 0.62 | RAB9A (0.36) | — | |
| SCHEMBL8555476 | 0.62 | — | — | |
| SCHEMBL8553882 | 0.62 | HDAC6 (0.37) | — | |
| SCHEMBL9090872 | 0.62 | KMT2A (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5846986-A | Therapeutic phenoxyalkylazoles and phenoxyalkylazines | SANOFI (FR) | 1998-12-08 | — | — | US | disclosed |
| US-5721261-A | TREATING PICORNAVIRUS INFECTIONS | SANOFI PHARMACEUTICALS, INC. (US) | 1998-02-24 | — | — | US | disclosed |