⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6685991 | 0.80 | — | — | |
| SCHEMBL11552846 | 0.80 | — | — | |
| SCHEMBL11668656 | 0.75 | KDM5B (0.33) | — | |
| SCHEMBL9191979 | 0.72 | — | — | |
| SCHEMBL11501976 | 0.71 | — | — | |
| SCHEMBL11394115 | 0.68 | — | — | |
| SCHEMBL6979733 | 0.62 | — | — | |
| SCHEMBL8692995 | 0.62 | — | — | |
| SCHEMBL18270961 | 0.60 | — | — | |
| SCHEMBL194190 | 0.60 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4511117-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | Vertex Pharmaceuticals Incorporated (US) | 2025-02-26 | — | — | EP | disclosed |
| WO-2024172341-A1 | QUANTUM DOT, METHOD FOR PREPARING QUANTUM DOT, QUANTUM DOT COMPOSITION, AND ELECTRONIC DEVICE | 덕산네오룩스 주식회사 | 2024-08-22 | — | — | WO | disclosed |
| WO-2024010703-A1 | THERMALLY CONDUCTIVE POLYMER COMPOSITION | TICONA LLC (US) | 2024-01-11 | — | — | WO | disclosed |
| WO-2023205465-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-10-26 | — | — | WO | disclosed |
| US-20210289794-A1 | COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE | FLAGSHIP PIONEERING INNOVATIONS V, INC. | 2021-09-23 | — | — | US | disclosed |
| CN-1184477-A | Pyrazole derivatives | IDEMITSU KOSAN CO (JP) | 1998-06-10 | — | — | CN | disclosed |