⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18824453 | 0.72 | — | — | |
| SCHEMBL25167280 | 0.72 | — | — | |
| SCHEMBL264827 | 0.66 | — | — | |
| SCHEMBL2274110 | 0.66 | — | — | |
| SCHEMBL5678521 | 0.64 | ALDH1A1 (0.40) | — | |
| SCHEMBL3378987 | 0.63 | — | — | |
| SCHEMBL3317969 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL28242620 | 0.57 | — | — | |
| SCHEMBL2267484 | 0.57 | — | — | |
| SCHEMBL5338942 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008085426-A1 | VOLATILE LIQUID COPPER PRECURSORS FOR THIN FILM APPLICATIONS | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2008-07-17 | — | — | WO | disclosed |