⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4299633 | 1.00 | — | — | |
| SCHEMBL467930 | 0.85 | TRPA1 (0.52) | — | |
| SCHEMBL467980 | 0.85 | TRPA1 (0.52) | — | |
| SCHEMBL467981 | 0.85 | TRPA1 (0.52) | — | |
| SCHEMBL448049 | 0.83 | ADRA2A (0.41) | — | |
| SCHEMBL20528139 | 0.81 | MGAM (0.46) | — | |
| SCHEMBL29283199 | 0.79 | TSHR (0.49) | — | |
| SCHEMBL25627241 | 0.79 | TSHR (0.49) | — | |
| SCHEMBL7745837 | 0.79 | TSHR (0.34) | — | |
| SCHEMBL6552702 | 0.79 | TSHR (0.52) | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114173563-A | Stable microbicide composition | 株式会社凯美科瑞亚 | 2022-03-11 | — | — | CN | claimed |
| WO-2020246452-A1 | STABLE MICROBICIDE COMPOSITION | 株式会社ケミクレア | 2020-12-10 | — | — | WO | claimed |
| WO-2002005637-A1 | COMPOSITIONS CONTAINING HOPS EXTRACT AND THEIR USE IN WATER SYSTEMS AND PROCESS STREAMS TO CONTROL BIOLOGICAL FOULING | ONDEO NALCO COMPANY (US) | 2002-01-24 | — | — | WO | claimed |
| EP-1109745-A4 | METHOD AND COMPOSITION FOR INHIBITING GROWTH OF MICROORGANISMS INCLUDING PERACETIC ACID AND A NON-OXIDIZING BIOCIDE | NALCO CHEMICAL CO (US) | 2001-12-05 | — | — | EP | claimed |
| EP-1109745-A1 | METHOD AND COMPOSITION FOR INHIBITING GROWTH OF MICROORGANISMS INCLUDING PERACETIC ACID AND A NON-OXIDIZING BIOCIDE | NALCO CHEMICAL COMPANY (US) | 2001-06-27 | — | — | EP | claimed |
| WO-2001011954-A2 | COMPOSITION AND METHOD FOR CONTROLLING BIOLOGICAL GROWTH USING STABILIZED SODIUM HYPOBROMITE IN SYNERGISTIC COMBINATIONS | NALCO CHEMICAL COMPANY (US) | 2001-02-22 | — | — | WO | claimed |
| WO-1999065827-A1 | METHOD AND COMPOSITION FOR INHIBITING GROWTH OF MICROORGANISMS INCLUDING PERACETIC ACID AND A NON-OXIDIZING BIOCIDE | NALCO CHEMICAL COMPANY (US) | 1999-12-23 | — | — | WO | claimed |
| EP-0835054-A1 | EMULSIFIED COMPOSITIONS OF 1,4-BIS(BROMOACETOXY)-2-BUTENE USEFUL AS A MICROBICIDE AND PRESERVATIVE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-04-15 | — | — | EP | claimed |
| JP-58183606-A | — | — | None | — | — | JP | disclosed |
| JP-11302105-A | — | — | None | — | — | JP | disclosed |
| JP-56154403-A | — | — | None | — | — | JP | disclosed |
| CN-111315718-B | Molecules having one hydrophobic group and two identical hydrophilic ionic groups and compositions thereof | 埃科莱布美国股份有限公司 | 2024-02-20 | — | — | CN | disclosed |
| US-11884660-B2 | Substituted oxopyridine derivative | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2024-01-30 | — | — | US | disclosed |
| CN-113840945-B | Use of multi-charged cationic compounds derived from polyamines and compositions thereof for corrosion inhibition in aqueous systems | 埃科莱布美国股份有限公司 | 2023-09-26 | — | — | CN | disclosed |
| WO-1996039828-A1 | EMULSIFIED COMPOSITIONS OF 1,4-BIS(BROMOACETOXY)-2-BUTENE USEFUL AS A MICROBICIDE AND PRESERVATIVE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1996-12-19 | — | — | WO | disclosed |
| WO-1996039828-A1 | EMULSIFIED COMPOSITIONS OF 1,4-BIS(BROMOACETOXY)-2-BUTENE USEFUL AS A MICROBICIDE AND PRESERVATIVE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1996-12-19 | — | — | WO | disclosed |
| JP-S58183606-A | NONMEDICAL AGENT INIMICAL TO MICROBE AND ALGA | KUMIAI CHEM IND CO LTD | 1983-10-26 | — | — | JP | disclosed |
| EP-0064761-A1 | Pickling and tanning process and pickling composition | SEITETSU KAGAKU CO., LTD. (JP) | 1982-11-17 | — | — | EP | disclosed |
| JP-S56154403-A | STABILIZED NONMEDICAL FUNGICIDE AND ALGICIDE COMPOSITION | KUMIAI CHEM IND CO LTD | 1981-11-30 | — | — | JP | disclosed |
| EP-0019435-A2 | A tanning process and tanning compositions | SEITETSU KAGAKU CO., LTD. (JP) | 1980-11-26 | — | — | EP | disclosed |