⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8649499 | 0.95 | — | — | |
| SCHEMBL21311 | 0.94 | — | — | |
| Hydrazine SCHEMBL28225770 | 0.89 | — | — | |
| Iodide SCHEMBL8346124 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL902203 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL7559311 | 0.89 | — | — | |
| Iodide SCHEMBL5699197 | 0.89 | — | — | |
| SCHEMBL3310527 | 0.89 | — | — | |
| SCHEMBL1291829 | 0.84 | — | — | |
| Iodide SCHEMBL28859824 | 0.84 | — | — |
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-1397475-A2 | COMPACTABLE POWDERS | HUNTSMAN INTERNATIONAL LLC (US) | 2004-03-17 | — | — | EP | disclosed |
| WO-2002102948-A2 | COMPACTABLE POWDERS | HUNTSMAN INTERNATIONAL LLC A LIMITED LIABILITY COMPANY FORMED UNDER THE LAWS OF DELAWARE, USA (US) | 2002-12-27 | — | — | WO | disclosed |