⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16248435 | 1.00 | — | — | |
| SCHEMBL19275819 | 1.00 | — | — | |
| SCHEMBL11064739 | 0.78 | TSHR (0.41) | — | |
| SCHEMBL185750 | 0.75 | — | — | |
| SCHEMBL9494396 | 0.75 | — | — | |
| SCHEMBL9497647 | 0.75 | — | — | |
| SCHEMBL8962163 | 0.73 | — | — | |
| Acetone SCHEMBL28634611 | 0.73 | — | — | |
| SCHEMBL8182250 | 0.73 | — | — | |
| SCHEMBL13858443 | 0.73 | — | — |
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 124 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7141693-B2 | Process for producing β-oxonitrile compound or alkali metal salt thereof | UBE INDUSTRIES, LTD. (JP) | 2006-11-28 | — | — | US | claimed |
| US-12492187-B2 | Factor XI activation inhibitors | MERCK SHARP & DOHME LLC (US) | 2025-12-09 | — | — | US | disclosed |
| CN-115403584-B | 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| US-20230147170-A1 | FACTOR XI ACTIVATION INHIBITORS | MERCK SHARP & DOHME LLC (US) | 2023-05-11 | — | — | US | disclosed |
| US-20230147170-A1 | FACTOR XI ACTIVATION INHIBITORS | MERCK SHARP & DOHME LLC (US) | 2023-05-11 | — | — | US | disclosed |
| EP-4125892-A1 | FACTOR XI ACTIVATION INHIBITORS | Merck Sharp & Dohme LLC (US) | 2023-02-08 | — | — | EP | disclosed |
| CN-115403584-A | 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-11-29 | — | — | CN | disclosed |
| WO-2021202254-A1 | FACTOR XI ACTIVATION INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2021-10-07 | — | — | WO | disclosed |
| US-10889589-B2 | Bicyclic urea, thiourea, guanidine and cyanoguanidine compounds useful for the treatment of pain | ARRAY BIOPHARMA INC. (US) | 2021-01-12 | — | — | US | disclosed |
| EP-3650514-A1 | ULTRAVIOLET CURABLE SILICONE ADHESIVE COMPOSITION AND SILICONE ADHESIVE FILM | Shin-Etsu Chemical Co., Ltd. (JP) | 2020-05-13 | — | — | EP | disclosed |
| CN-1562985-A | Preparation method of 5-substituted-3-aminoisoxazole compound | SHANGHAI INST OPTICS & FINE ME (CN) | 2005-01-12 | — | — | CN | disclosed |
| US-20040171863-A1 | Process for poducing beta-oxonitrile compound or alkali metal salt thereof | UBE INDUSTRIES, LTD. (JP) | 2004-09-02 | — | — | US | disclosed |
| EP-0296550-B1 | Phosphonium salts and processes for production of and uses for the same | KURARAY CO (JP) | 1993-12-29 | — | — | EP | disclosed |
| US-5100854-A | Telomerization catalysts | KURARAY CO., LTD. (JP) | 1992-03-31 | — | — | US | disclosed |
| US-4992609-A | Telomerization catalysts | KURARAY CO., LTD. (JP) | 1991-02-12 | — | — | US | disclosed |
| US-4927960-A | TELOMERIZATION CATALYST | KURARAY COMPANY, LTD. (JP) | 1990-05-22 | — | — | US | disclosed |
| EP-0296550-A2 | Phosphonium salts and processes for production of and uses for the same | KURARAY CO., LTD. (JP) | 1988-12-28 | — | — | EP | disclosed |
| US-4363816-A | TREATMENT OF GASTROINTESTINAL DISORDERS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1982-12-14 | — | — | US | disclosed |
| US-4234594-A | Pyrazolyl amino imidazolines as antihypertensive agents | ABBOTT LABORATORIES (US) | 1980-11-18 | — | — | US | disclosed |
| US-4226773-A | Pyrazolyl amino imidazolines as diuretic agents | ABBOTT LABORATORIES (US) | 1980-10-07 | — | — | US | disclosed |