⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3608 | 0.93 | — | — | |
| SCHEMBL29921519 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL21596295 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL11064037 | 0.89 | — | — | |
| SCHEMBL23319722 | 0.89 | — | — | |
| Fluoride SCHEMBL25337972 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL11717158 | 0.89 | — | — | |
| SCHEMBL28166849 | 0.89 | — | — | |
| Propane SCHEMBL5723751 | 0.89 | — | — | |
| Methylene Chloride SCHEMBL26983527 | 0.83 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6806289-B1 | SUCH AS AMMINE (2-AMINO-3-PICOLINE) DICHLOROPLATINUM(II); EFFICIENCY AND SELECTIVITY FOR DESTROYING TRANSFORMED CELLS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-10-19 | — | — | US | disclosed |