⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9910066 | 0.76 | — | — | |
| SCHEMBL3728159 | 0.67 | — | — | |
| SCHEMBL20842524 | 0.66 | JAK3 (0.33) | — | |
| SCHEMBL1708322 | 0.62 | — | — | |
| SCHEMBL10205055 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL4013495 | 0.59 | — | — | |
| SCHEMBL24287629 | 0.58 | — | — | |
| SCHEMBL22692966 | 0.58 | HTR1D (0.32) | — | |
| SCHEMBL12654575 | 0.58 | — | — | |
| SCHEMBL10481830 | 0.58 | GSTP1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109745321-A | Pharmaceutical composition comprising FGFR4 inhibitor | 上海翰森生物医药科技有限公司 | 2019-05-14 | — | — | CN | disclosed |