⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL80807 | 0.79 | — | — | |
| SCHEMBL35443 | 0.79 | — | — | |
| Ammonia Solution, Strong SCHEMBL28213257 | 0.75 | — | — | |
| SCHEMBL4861233 | 0.69 | — | — | |
| SCHEMBL17041900 | 0.69 | — | — | |
| SCHEMBL11138153 | 0.67 | — | — | |
| Diethylamine SCHEMBL15105159 | 0.65 | TP53 (0.53) | — | |
| SCHEMBL27764886 | 0.62 | MEN1 (0.40) | — | |
| SCHEMBL2546427 | 0.60 | TSHR (0.33) | — | |
| SCHEMBL8134713 | 0.60 | — | — |
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-2278046-A1 | Precursors for cvd silicon carbo-nitride films | Air Products and Chemicals, Inc. (US) | 2011-01-26 | — | — | EP | disclosed |