⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1188188 | 0.82 | — | — | |
| Phosphine SCHEMBL8039922 | 0.82 | — | — | |
| Phosphine SCHEMBL317312 | 0.82 | — | — | |
| Phosphine SCHEMBL4732238 | 0.82 | — | — | |
| Phosphine SCHEMBL1188186 | 0.82 | — | — | |
| Water SCHEMBL6135856 | 0.67 | — | — | |
| Phosphine SCHEMBL10440123 | 0.67 | — | — | |
| Phosphine SCHEMBL6047119 | 0.67 | — | — | |
| Phosphine SCHEMBL4077671 | 0.67 | — | — | |
| SCHEMBL11884752 | 0.67 | — | — |
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-5360895-A | Derivatized gold clusters and antibody-gold cluster conjugates | ASSOCIATED UNIVERSITIES, INC. (US) | 1994-11-01 | — | — | US | disclosed |