⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26151376 | 0.83 | NOTUM (0.36) | — | |
| SCHEMBL2621618 | 0.82 | IDO1 (0.37) | — | |
| SCHEMBL22515608 | 0.80 | IDO1 (0.33) | — | |
| SCHEMBL20272644 | 0.78 | — | — | |
| SCHEMBL20458029 | 0.78 | — | — | |
| SCHEMBL26772340 | 0.78 | — | — | |
| SCHEMBL24991561 | 0.75 | — | — | |
| SCHEMBL21729612 | 0.75 | — | — | |
| SCHEMBL21419598 | 0.75 | ACHE (0.36) | — | |
| SCHEMBL19589446 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023212240-A1 | COMPOUNDS FOR INHIBITING KIF18A | VOLASTRA THERAPEUTICS, INC. (US) | 2023-11-02 | — | — | WO | disclosed |
| US-20200407712-A1 | ARRAY-BASED CYCLIC PEPTIDE LIBRARIES | Cowper Sciences Inc. | 2020-12-31 | — | — | US | disclosed |