SCHEMBL5553113

SCHEMBL5553113

CC(=O)N(CC(O)CO)c1c(I)c(C(N)=O)c(I)c(C(=O)NCC(O)CO)c1I

nearest known ligand 0.91

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.91
HIF1A Q16665 1/20 0.91
LMNA P02545 4/20 0.86
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
CYP2C9 P11712 1/20 0.32
MAP2K1 Q02750 5/20 0.31
MAP2K2 P36507 1/20 0.30
PRKCZ Q05513 1/20 0.30
IARS2 Q9NSE4 1/20 0.30

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
Iohexol SCHEMBL26501 0.95 CYP2C19 (1.00) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL31722694 0.95 CYP2C19 (1.00) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL8844889 0.95 CYP2C19 (1.00) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL37920 0.95 CYP2C19 (1.00) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL8711982 0.94 CYP2C19 (0.97) CYP2C19HIF1ALMNAEGFRSRC
Iodixanol SCHEMBL22645199 0.94 LMNA (0.97) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL22719758 0.93 CYP2C19 (0.95) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL3666605 0.93 CYP2C19 (0.95) CYP2C19HIF1ALMNAEGFRSRC
Iodixanol SCHEMBL37712 0.93 LMNA (1.00) CYP2C19HIF1ALMNAEGFRSRC
Iodixanol SCHEMBL8845042 0.93 LMNA (1.00) CYP2C19HIF1ALMNAEGFRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5698739-A RADIOLOGY SCHERING AKTIENGESELLSCHAFT (DE) 1997-12-16 US claimed
EP-0406992-B1 New non-ionic carboxamide contrast agent SCHERING AG (DE) 1995-03-15 EP claimed
US-4816168-A TUBES FOR BLOOD SEPARATION BECTON DICKINSON & COMPANY (US) 1989-03-28 US claimed
US-4640785-A Separation of lymphocytes and monocytes from blood samples BECTON DICKINSON AND COMPANY (US) 1987-02-03 US claimed
CN-117460995-A Composition for forming underlayer film of silicon-containing resist 日产化学株式会社 2024-01-26 CN disclosed
WO-2023117667-A1 PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODOISOPHTHALIC BISAMIDES BRACCO IMAGING SPA (IT) 2023-06-29 WO disclosed
CN-114340531-A Devices, systems, and methods for assisting balloon ablation 皇家飞利浦有限公司 2022-04-12 CN disclosed
CN-108261561-B Developable hyaluronic acid microsphere embolic agent as well as preparation method and application thereof 杭州协合医疗用品有限公司 2021-04-23 CN disclosed
CN-112601557-A Cell-based assays for measuring the efficacy of pharmaceutical products 诺华股份有限公司 2021-04-02 CN disclosed
CN-103356206-A System and method for contrast agent estimation in X-ray imaging GEN ELECTRIC 2013-10-23 CN disclosed
CN-102816085-B Preparation method of iohexol impurity ZHEJIANG STARRY PHARMACEUTICAL CO LTD 2013-08-14 CN disclosed
CN-102816085-A Preparation method of iohexol impurity ZHEJIANG STARRY PHARMACEUTICAL CO LTD 2012-12-12 CN disclosed
US-5698739-A RADIOLOGY SCHERING AKTIENGESELLSCHAFT (DE) 1997-12-16 US disclosed
EP-0406992-B1 New non-ionic carboxamide contrast agent SCHERING AG (DE) 1995-03-15 EP disclosed
US-5349085-A IODIXANOL; 1,3-bis(acetylamino)-N,N'-bis(3,5-bis(2,3dihydroxypropylaminocarbonyl)-2,4,6-triiodophenyl)-2-hydroxypropane NYCOMED IMAGING AS (NO) 1994-09-20 US disclosed
EP-0406992-A2 New non-ionic carboxamide contrast agent SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-09 EP disclosed
US-4640785-A Separation of lymphocytes and monocytes from blood samples BECTON DICKINSON AND COMPANY (US) 1987-02-03 US disclosed
EP-0190488-A1 Separation of lymphocytes and monocytes from blood samples Becton, Dickinson and Company (US) 1986-08-13 EP disclosed
EP-0108638-B1 X-RAY CONTRAST AGENTS NYEGAARD & CO. A/S (NO) 1986-07-16 EP disclosed
EP-0108638-A1 X-ray contrast agents NYEGAARD & CO. A/S (NO) 1984-05-16 EP disclosed