⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2043792 | 0.84 | — | — | |
| SCHEMBL2826221 | 0.81 | — | — | |
| SCHEMBL2828998 | 0.80 | — | — | |
| SCHEMBL20165 | 0.79 | DHFR (0.33) | — | |
| SCHEMBL1665906 | 0.79 | PNP (0.31) | — | |
| SCHEMBL2938692 | 0.77 | PNP (0.31) | — | |
| SCHEMBL26506 | 0.77 | SUMO1 (0.36) | — | |
| SCHEMBL2512344 | 0.77 | SUMO1 (0.36) | — | |
| SCHEMBL7597747 | 0.76 | MPO (0.38) | — | |
| SCHEMBL29512549 | 0.76 | SUMO1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11839661-B2 | Rapid formation of supramolecular hydrogels by short peptide and bioactive small molecules | BRANDEIS UNIVERSITY (US) | 2023-12-12 | — | — | US | disclosed |
| US-20210128745-A1 | RAPID FORMATION OF SUPRAMOLECULAR HYDROGELS BY SHORT PEPTIDE AND BIOACTIVE SMALL MOLECULES | BRANDEIS UNIVERSITY | 2021-05-06 | — | — | US | disclosed |
| WO-2019035928-A1 | RAPID FORMATION OF SUPRAMOLECULAR HYDROGELS BY SHORT PEPTIDE AND BIOACTIVE SMALL MOLECULES | BRANDEIS UNIVERSITY (US) | 2019-02-21 | — | — | WO | disclosed |