⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14659169 | 0.89 | — | — | |
| SCHEMBL27459301 | 0.66 | DAO (0.32) | — | |
| SCHEMBL1791619 | 0.66 | ALDH1A1 (0.38) | — | |
| SCHEMBL4011812 | 0.66 | DAO (0.32) | — | |
| SCHEMBL14658009 | 0.65 | — | — | |
| SCHEMBL14659667 | 0.65 | ABCC9 (0.30) | — | |
| SCHEMBL19323695 | 0.64 | MAPK14 (0.32) | — | |
| SCHEMBL1924912 | 0.64 | DAO (0.31) | — | |
| SCHEMBL1794431 | 0.64 | ALDH1A1 (0.37) | — | |
| SCHEMBL14658346 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130030191-A1 | Group IV Metal Complexes For Metal-Containing Film Deposition | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2013-01-31 | — | — | US | claimed |
| US-20130030191-A1 | Group IV Metal Complexes For Metal-Containing Film Deposition | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2013-01-31 | — | — | US | disclosed |