⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1008298 | 1.00 | — | — | |
| SCHEMBL15838937 | 1.00 | — | — | |
| SCHEMBL7511004 | 0.88 | NOS1 (0.38) | — | |
| SCHEMBL1761057 | 0.86 | ALDH1A1 (0.41) | — | |
| SCHEMBL7288800 | 0.84 | ALDH1A1 (0.44) | — | |
| SCHEMBL11264708 | 0.84 | ALDH1A1 (0.44) | — | |
| SCHEMBL16953 | 0.82 | — | — | |
| SCHEMBL1006882 | 0.82 | — | — | |
| SCHEMBL1006247 | 0.82 | — | — | |
| SCHEMBL27309112 | 0.81 | — | — |
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-7863271-B2 | 2-aminobenzoxazole carboxamides as 5HT3 modulators | ALBANY MOLECULAR RESEARCH, INC. (US) | 2011-01-04 | — | — | US | disclosed |
| US-20080255114-A1 | 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS | AMR TECHNOLOGY, INC. (US) | 2008-10-16 | — | — | US | disclosed |