⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7506111 | 0.94 | — | — | |
| SCHEMBL5851125 | 0.76 | — | — | |
| Hexane SCHEMBL29216668 | 0.68 | TSHR (0.30) | — | |
| SCHEMBL1373411 | 0.67 | — | — | |
| Tetradecane SCHEMBL28024811 | 0.67 | TSHR (0.35) | — | |
| SCHEMBL7214676 | 0.66 | — | — | |
| SCHEMBL284854 | 0.66 | — | — | |
| Hexane SCHEMBL28311153 | 0.66 | TSHR (0.32) | — | |
| Octane SCHEMBL28018307 | 0.66 | TSHR (0.38) | — | |
| SCHEMBL7577764 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2002114796-A | RUTHENIUM COMPOUND FOR CHEMICAL VAPOR DEPOSITION AND METHOD FOR CHEMICAL VAPOR DEPOSITION OF RUTHENIUM THIN FILM OR RUTHENIUM COMPOUND THIN FILM | TANAKA KIKINZOKU KOGYO KK | 2002-04-16 | — | — | JP | disclosed |