⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8486581 | 0.97 | — | — | |
| SCHEMBL21575 | 0.97 | — | — | |
| SCHEMBL13745483 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL19376413 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL19376416 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL19376414 | 0.93 | — | — | |
| Formaldehyde SCHEMBL2411333 | 0.88 | — | — | |
| Phosphonic Acid SCHEMBL30541725 | 0.83 | GABRR1 (0.39) | — | |
| SCHEMBL6901467 | 0.82 | GABRR1 (0.45) | — | |
| SCHEMBL3229134 | 0.82 | — | — |
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-5665679-A | COPPER-ETHYLENEDIAMINE COMPLEX | GRIFFIN CORPORATION (US) | 1997-09-09 | — | — | US | disclosed |