⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1133058 | 0.80 | — | — | |
| SCHEMBL9057655 | 0.78 | KMT2A (0.35) | — | |
| SCHEMBL28513567 | 0.78 | KMT2A (0.35) | — | |
| SCHEMBL4581047 | 0.76 | — | — | |
| SCHEMBL25418892 | 0.75 | — | — | |
| SCHEMBL20582655 | 0.75 | CNR2 (0.38) | — | |
| Propionic Acid SCHEMBL23646926 | 0.75 | FFAR3 (0.39) | — | |
| Hydrochloric Acid SCHEMBL7544459 | 0.73 | — | — | |
| SCHEMBL2655550 | 0.71 | — | — | |
| SCHEMBL28685155 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020250855-A1 | CYCLIC PEPTIDE, CELL SCAFFOLD MATERIAL, CELL SEPARATION MATERIAL AND CULTURE MEDIUM | 富士フイルム株式会社 | 2020-12-17 | — | — | WO | disclosed |