⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8045602 | 1.00 | — | — | |
| SCHEMBL27238088 | 1.00 | — | — | |
| SCHEMBL731183 | 1.00 | — | — | |
| SCHEMBL22703465 | 1.00 | — | — | |
| SCHEMBL14160061 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL4925852 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL9015304 | 0.97 | — | — | |
| SCHEMBL146185 | 0.87 | TRPV1 (0.42) | — | |
| SCHEMBL1132029 | 0.81 | — | — | |
| SCHEMBL10353940 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2090323-B1 | Hyperbranched polymer conjugates via non-enzymatic cleavable linker | ASCENDIS PHARMA GROWTH DISORDERS DIVISION AS (DK) | 2016-07-27 | — | — | EP | disclosed |
| WO-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |