⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6577101 | 1.00 | — | — | |
| SCHEMBL491813 | 1.00 | — | — | |
| SCHEMBL27789715 | 0.77 | — | — | |
| SCHEMBL108561 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL1515897 | 0.74 | — | — | |
| SCHEMBL10778756 | 0.74 | — | — | |
| E968 SCHEMBL17062 | 0.74 | — | — | |
| E968 SCHEMBL6729753 | 0.74 | — | — | |
| E968 SCHEMBL2723809 | 0.74 | LMNA (0.67) | — | |
| E968 SCHEMBL10427336 | 0.74 | — | — |
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-20040214881-A1 | Method for producing optically active halopropanediol derivative | KANEKA CORPORATION (JP) | 2004-10-28 | — | — | US | disclosed |
| EP-1422213-A1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE HALOPROPANEDIOL DERIVATIVE | KANEKA CORPORATION (JP) | 2004-05-26 | — | — | EP | disclosed |