⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23864573 | 0.93 | — | — | |
| SCHEMBL23864447 | 0.92 | AKR1C3 (0.36) | — | |
| SCHEMBL23864210 | 0.89 | HPGD (0.35) | — | |
| SCHEMBL23864302 | 0.88 | BCHE (0.31) | — | |
| SCHEMBL23864599 | 0.80 | HTT (0.36) | — | |
| SCHEMBL23864738 | 0.78 | HPGD (0.34) | — | |
| SCHEMBL23864683 | 0.78 | NR1H4 (0.35) | — | |
| SCHEMBL23864208 | 0.77 | HPGD (0.32) | — | |
| SCHEMBL23864267 | 0.76 | TAS1R3 (0.41) | — | |
| SCHEMBL23864539 | 0.75 | HPGD (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2968330-B1 | COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS | SCRIPPS RESEARCH INST (US) | 2021-09-29 | — | — | EP | disclosed |