⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23176224 | 0.73 | — | — | |
| SCHEMBL11822373 | 0.67 | TP53 (0.36) | — | |
| SCHEMBL22849646 | 0.66 | — | — | |
| SCHEMBL23823345 | 0.66 | — | — | |
| SCHEMBL9036380 | 0.62 | — | — | |
| SCHEMBL236564 | 0.62 | — | — | |
| SCHEMBL163557 | 0.62 | — | — | |
| SCHEMBL559604 | 0.60 | TP53 (0.38) | — | |
| SCHEMBL27910344 | 0.60 | TP53 (0.53) | — | |
| SCHEMBL18994701 | 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 |
|---|---|---|---|---|---|---|---|
| CN-109563094-A | Acyclic derivatives, their preparation method and the pharmaceutical composition containing them that new (miscellaneous) aryl replaces | 法国施维雅药厂 | 2019-04-02 | — | — | CN | disclosed |