⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3831408 | 0.97 | — | — | |
| SCHEMBL189387 | 0.67 | — | — | |
| SCHEMBL3095719 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11210256 | 0.65 | — | — | |
| SCHEMBL9309865 | 0.63 | — | — | |
| SCHEMBL11157956 | 0.63 | CYP3A4 (0.30) | — | |
| SCHEMBL11274570 | 0.61 | — | — | |
| SCHEMBL13208621 | 0.61 | L3MBTL1 (0.43) | — | |
| SCHEMBL10859287 | 0.61 | — | — | |
| SCHEMBL3108510 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0195147-B1 | TRIHALO(AMINE)GOLD(III) COMPLEXES | ENGELHARD CORPORATION (US) | 1989-11-08 | — | — | EP | disclosed |