⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL59559 | 1.00 | — | — | |
| SCHEMBL29107152 | 1.00 | — | — | |
| SCHEMBL28419581 | 0.82 | — | — | |
| SCHEMBL1286351 | 0.82 | — | — | |
| Lithium Ion SCHEMBL28421799 | 0.82 | — | — | |
| Potassium Ion SCHEMBL28426311 | 0.82 | — | — | |
| Methane SCHEMBL28884810 | 0.82 | — | — | |
| SCHEMBL5428632 | 0.82 | — | — | |
| SCHEMBL5440409 | 0.82 | — | — | |
| SCHEMBL28524475 | 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-4485152-A | Superconducting type II palladium alloy hydride-palladium hydride composites | RESEARCH FOUNDATION, STATE UNIVERSITY OF NEW YORK (US) | 1984-11-27 | — | — | US | disclosed |