⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL626852 | 0.93 | — | — | |
| SCHEMBL27315946 | 0.90 | — | — | |
| SCHEMBL27496274 | 0.88 | — | — | |
| SCHEMBL5070254 | 0.87 | TSHR (0.35) | — | |
| SCHEMBL18600102 | 0.87 | TSHR (0.35) | — | |
| SCHEMBL8994354 | 0.86 | — | — | |
| SCHEMBL27882653 | 0.86 | TSHR (0.38) | — | |
| SCHEMBL8393191 | 0.86 | CES2 (0.33) | — | |
| SCHEMBL28806069 | 0.85 | LMNA (0.30) | — | |
| SCHEMBL7904738 | 0.85 | TSHR (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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0236215-B1 | 2,2'-DIFLUORO-4-ALKOXY-4'-HYDROXY BIPHENYLS AND THEIR DERIVATIVES, THEIR PRODUCTION PROCESS AND THEIR USE IN LIQUID CRYSTAL DISPLAY DEVICES | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 1990-01-10 | — | — | EP | claimed |
| CN-115309734-A | Multi-source heterogeneous data processing method for transformer substation | 广东电网有限责任公司东莞供电局 | 2022-11-08 | — | — | CN | disclosed |
| EP-2958883-A1 | CYCLOHEXENONE COMPOSITIONS AND PROCESS FOR MAKING THEREOF | Golden Biotechnology Corporation (US) | 2015-12-30 | — | — | EP | disclosed |
| WO-2014130618-A1 | CYCLOHEXENONE COMPOSITIONS AND PROCESS FOR MAKING THEREOF | GOLDEN BIOTECHNOLOGY CORPORATION (US) | 2014-08-28 | — | — | WO | disclosed |
| US-7074927-B2 | Heterocyclic amines having central nervous system activity | PHARMACIA & UPJOHN COMPANY (US) | 2006-07-11 | — | — | US | disclosed |
| US-20050107378-A1 | Heterocyclic amines having central nervous system activity | ROMERO ARTHUR G (US) | 2005-05-19 | — | — | US | disclosed |
| US-5077287-A | Treating infectious diseases in man and animals | ELI LILLY AND COMPANY (US) | 1991-12-31 | — | — | US | disclosed |