⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12091710 | 0.72 | NOS1 (0.31) | — | |
| SCHEMBL11410132 | 0.72 | CRBN (0.32) | — | |
| SCHEMBL21087596 | 0.65 | — | — | |
| SCHEMBL21092305 | 0.65 | NAALAD2 (0.38) | — | |
| SCHEMBL27660339 | 0.65 | TSHR (0.32) | — | |
| SCHEMBL16221699 | 0.63 | MEN1 (0.42) | — | |
| SCHEMBL6720557 | 0.63 | HPGD (0.35) | — | |
| SCHEMBL9913289 | 0.63 | KDM4E (0.39) | — | |
| SCHEMBL19781667 | 0.63 | TSHR (0.30) | — | |
| SCHEMBL6720560 | 0.63 | KDM4C (0.35) | — |
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-2019217757-A1 | METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE | DESIGN THERAPEUTICS INC. (US) | 2019-11-14 | — | — | WO | disclosed |