⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL726002 | 0.75 | — | — | |
| SCHEMBL395553 | 0.71 | — | — | |
| SCHEMBL83729 | 0.71 | — | — | |
| SCHEMBL9249941 | 0.69 | — | — | |
| SCHEMBL726179 | 0.67 | — | — | |
| SCHEMBL4572698 | 0.64 | — | — | |
| SCHEMBL2223515 | 0.64 | TSHR (0.39) | — | |
| SCHEMBL13018008 | 0.62 | — | — | |
| SCHEMBL15972107 | 0.61 | TSHR (0.36) | — | |
| SCHEMBL10514508 | 0.61 | TSHR (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210206809-A1 | PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY | VERA THERAPEUTICS INC (US) | 2021-07-08 | — | — | US | disclosed |