SCHEMBL127491

SCHEMBL127491

BrCc1ccc(I)cc1

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7763204 0.92 TRPA1 (0.43)
SCHEMBL14948463 0.85 APP (0.39)
SCHEMBL131361 0.83 ALDH1A1 (0.67)
Benzyl Bromide SCHEMBL3032661 0.80 TSHR (0.74)
SCHEMBL15201372 0.80 TRPA1 (0.50)
SCHEMBL1263503 0.77 TDP1 (0.55)
SCHEMBL18608404 0.75 TRPA1 (0.50)
SCHEMBL5885289 0.73 ALDH1A1 (0.56)
SCHEMBL6510298 0.73 CYP3A4 (0.50)
SCHEMBL2220712 0.73 TRPA1 (0.56)

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 1527 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115959962-B Visible light-promoted halogenated alkane hydrodehalogenation method 中国科学院兰州化学物理研究所 2025-05-23 CN claimed
CN-115850002-B Method for hydrodehalogenating halogenated alkane 中国科学院兰州化学物理研究所 2025-05-23 CN claimed
CN-119081037-A COF-based heterogeneous iodobenzene catalyst and preparation method and application thereof 山东师范大学 2024-12-06 CN claimed
CN-117843438-A Synthesis method of 4-iodostyrene 成都东凯芯半导体材料有限公司 2024-04-09 CN claimed
CN-117586440-B Iodinated polyhydroxy polymer, preparation method and liquid embolic agent prepared from iodinated polyhydroxy polymer 苏州美创医疗科技有限公司 2024-04-09 CN claimed
CN-117586440-A Iodinated polyhydroxy polymer, preparation method and liquid embolic agent prepared from iodinated polyhydroxy polymer 苏州美创医疗科技有限公司 2024-02-23 CN claimed
CN-114292197-A Organic ligand L, preparation method thereof, chiral catalyst and application 山东师范大学 2022-04-08 CN claimed
CN-110028394-A A kind of synthetic method of indone and its derivative 南京邮电大学 2019-07-19 CN claimed
CN-109896920-A A kind of luxuriant and rich with fragrance and its derivative synthetic method 南京邮电大学 2019-06-18 CN claimed
CN-108299383-A The method of palladium chtalyst one pot process oil-source rock correlation 南京邮电大学 2018-07-20 CN claimed
CN-102781974-A Radiopaque, non-biodegradable, water-insoluble iodinated benzyl ethers of poly (vinyl alcohol), process for their preparation, injectable embolizing compositions containing them and uses thereof UNIV CLAUDE BERNARD LYON 1 UCBL 2012-11-14 CN claimed
WO-2011110589-A1 RADIOPAQUE, NON- BIODEGRADABLE, WATER - INSOLUBLE IODINATED BENZYL ETHERS OF POLY (VINYL ALCOHOL), PREPARATION METHOD THEREOF, INJECTABLE EMBOLIZING COMPOSITIONS CONTAINING THEREOF AND USE THEREOF UNIVERSITÉ CLAUDE BERNARD LYON 1 (UCBL) (FR) 2011-09-15 WO claimed
EP-2365009-A1 Radiopaque, non-biodegradable, water-insoluble iodinated benzyl ethers of poly(vinyl alcohol), preparation method thereof, injectable embolizing compositions containing thereof and use thereof Universite Claude Bernard Lyon 1 (UCBL) (FR) 2011-09-14 EP claimed
EP-1853591-B1 METHOD FOR OBTAINING A PHARMACEUTICALLY ACTIVE COMPOUND (IRBESARTAN) AND ITS SYNTHESIS INTERMEDIATE INKE SA (ES) 2009-11-25 EP claimed
US-20090124677-A1 Method For Obtaining A Pharmaceutically Active Compound (Irbesartan) And Its Synthesis Intermediate INKE, S.A. (ES) 2009-05-14 US claimed
EP-1963344-A1 ORGANOPHOSPHORIC DERIVATIVES USEFUL AS ANTI-PARASITIC AGENTS UNIVERSITEIT GENT (BE) 2008-09-03 EP claimed
CN-101155803-A Method for obtaining a pharmaceutically active compound (irbesartan) and its synthesis intermediate INKE SA (ES) 2008-04-02 CN claimed
EP-1853591-A1 METHOD FOR OBTAINING A PHARMACEUTICALLY ACTIVE COMPOUND (IRBESARTAN) AND ITS SYNTHESIS INTERMEDIATE INKE, S.A. (ES) 2007-11-14 EP claimed
WO-2007071453-A1 ORGANOPHOSPHORIC DERIVATIVES USEFUL AS ANTI-PARASITIC AGENTS UNIVERSITEIT GENT (BE) 2007-06-28 WO claimed
WO-2006089927-A1 METHOD FOR OBTAINING A PHARMACEUTICALLY ACTIVE COMPOUND (IRBESARTAN) AND ITS SYNTHESIS INTERMEDIATE INKE, S.A. (ES) 2006-08-31 WO claimed