SCHEMBL467981

SCHEMBL467981

O=C(CBr)OCC=CCOC(=O)CBr

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.52
ALDH1A1 P00352 2/20 0.52
CYP2C19 P33261 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 2/20 0.33
FAAH O00519 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL467930 1.00 TRPA1 (0.52) TRPA1ALDH1A1CYP2C19L3MBTL1TSHR
SCHEMBL467980 1.00 TRPA1 (0.52) TRPA1ALDH1A1CYP2C19L3MBTL1TSHR
SCHEMBL467983 0.91 TRPA1 (0.44) TRPA1ALDH1A1CYP2C19L3MBTL1
SCHEMBL467982 0.91 TRPA1 (0.44) TRPA1ALDH1A1CYP2C19L3MBTL1
SCHEMBL467645 0.87 TRPA1 (0.41) TRPA1ALDH1A1CYP2C19L3MBTL1
SCHEMBL467644 0.87 TRPA1 (0.41) TRPA1ALDH1A1CYP2C19L3MBTL1
SCHEMBL4299633 0.85
SCHEMBL4299631 0.85
SCHEMBL299657 0.79
SCHEMBL20262189 0.79 FAAH (0.59) CYP2C19FAAH

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 420 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3977855-B1 STABLE MICROBICIDE COMPOSITION CHEMICREA INC (JP) 2025-12-24 EP claimed
US-12408668-B2 Stable microbicide composition CHEMICREA INC. (JP) 2025-09-09 US claimed
CN-119287656-A Moisture-absorbing antibacterial functional composite textile fiber and preparation method thereof 吴江市攀越纺织有限公司 2025-01-10 CN claimed
CN-117867889-A Coating for improving doctor blade mark of coated white cardboard and preparation method thereof 山东博汇纸业股份有限公司 2024-04-12 CN claimed
CN-117209380-A Synthesis method of 1, 4-bis (bromoethanoyloxy) -2-butene (BBAB) 江苏沃德化工有限公司 2023-12-12 CN claimed
US-20220202015-A1 STABLE MICROBICIDE COMPOSITION CHEMICREA INC. (JP) 2022-06-30 US claimed
EP-3977855-A1 STABLE MICROBICIDE COMPOSITION Chemicrea Inc. (JP) 2022-04-06 EP claimed
CN-114173563-A Stable microbicide composition 株式会社凯美科瑞亚 2022-03-11 CN claimed
US-11186499-B2 Methods of inhibiting fouling in liquid systems ECOLAB USA INC. (US) 2021-11-30 US claimed
US-20210292205-A1 SYSTEM AND METHOD FOR TREATING MEDICAL SEWAGE CONTAINING SARS-CoV-2 BASED ON NANO GRAPHENE UNIV SHAOGUAN (CN) 2021-09-23 US claimed
EP-0571313-B1 An industrial microbicide and a method for killing microbes for industrial use KATAYAMA CHEMICAL WORKS CO (JP) 1999-03-03 EP claimed
EP-0615688-B1 An industrial microbicide and a method for killing microbes for industrial use KATAYAMA CHEMICAL WORKS CO (JP) 1997-11-12 EP claimed
US-5681851-A BACTERICIDE, FUNGICIDE BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-10-28 US claimed
US-5641411-A CONTACTING WITH WATER SOLUBLE THIOL COMPOUND ROHM AND HAAS COMPANY (US) 1997-06-24 US claimed
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 claimed
EP-0744382-A1 Method of detoxifying industrial discharge waters ROHM AND HAAS COMPANY (US) 1996-11-27 EP claimed
US-5411990-A Dioxime derivative YOSHITOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1995-05-02 US claimed
EP-0615688-A1 An industrial microbicide and a method for killing microbes for industrial use KATAYAMA CHEMICAL, INC. (JP) 1994-09-21 EP claimed
EP-0571313-A2 An industrial microbicide and a method for killing microbes for industrial use KATAYAMA CHEMICAL, INC. (JP) 1993-11-24 EP claimed
US-4647577-A Microbicidal/microbistatic compositions for industrial use employing 4,5-dichloro-1,2-dithiol-3-one and haloacetic acid esters as the active agents KATAYAMA CHEMICAL WORKS CO., LTD. (JP) 1987-03-03 US claimed