⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15080740 | 0.94 | — | — | |
| SCHEMBL8966395 | 0.94 | — | — | |
| SCHEMBL203306 | 0.94 | — | — | |
| SCHEMBL1358640 | 0.94 | — | — | |
| SCHEMBL14341820 | 0.94 | — | — | |
| SCHEMBL12342610 | 0.94 | — | — | |
| SCHEMBL665219 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL11705775 | 0.89 | — | — | |
| SCHEMBL13078051 | 0.88 | — | — | |
| Potassium Ion SCHEMBL9235449 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4810436-A | PREPARED FROM DECABORANE AND AN AMINE OR PHOSPHINE | HOECHST CELANESE CORP. (US) | 1989-03-07 | — | — | US | disclosed |