⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2092883 | 0.87 | ALDH1A1 (0.31) | — | |
| SCHEMBL942964 | 0.80 | DDB1 (0.33) | — | |
| SCHEMBL364380 | 0.78 | GAA (0.42) | — | |
| SCHEMBL10523365 | 0.78 | TSHR (0.38) | — | |
| SCHEMBL6002466 | 0.78 | — | — | |
| SCHEMBL17103192 | 0.77 | FFAR1 (0.33) | — | |
| SCHEMBL9958753 | 0.77 | DDB1 (0.31) | — | |
| SCHEMBL28712281 | 0.73 | RHEB (0.38) | — | |
| SCHEMBL7524628 | 0.72 | TSHR (0.39) | — | |
| SCHEMBL10600724 | 0.72 | CA12 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1678185-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-07-12 | — | — | EP | disclosed |
| WO-2005042542-A1 | 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2005-05-12 | — | — | WO | disclosed |