⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL15331255 | 0.75 | LMNA (0.58) | — | |
| SCHEMBL15769086 | 0.71 | LMNA (0.65) | — | |
| SCHEMBL5271043 | 0.71 | GAA (0.36) | — | |
| SCHEMBL14892917 | 0.70 | — | — | |
| SCHEMBL21853414 | 0.70 | NCOA1 (0.35) | — | |
| SCHEMBL12194379 | 0.70 | TSHR (0.41) | — | |
| SCHEMBL14892918 | 0.68 | — | — | |
| SCHEMBL14091342 | 0.67 | PDPK1 (0.36) | — | |
| SCHEMBL1921176 | 0.63 | — | — | |
| Urea SCHEMBL9301106 | 0.62 | LMNA (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107474039-A | Ketone containing triazole and the 4- phenoxy groups substituted quinoline derivatives of imidazoles and its application | 沈阳药科大学 | 2017-12-15 | — | — | CN | claimed |
| US-20260007672-A1 | INHIBITORS OF MPTP | NRG THERAPEUTICS LTD (GB) | 2026-01-08 | — | — | US | disclosed |