SCHEMBL4833943

SCHEMBL4833943

NC(=O)c1c(I)c(N)c(I)c(C(N)=O)c1I

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.35
IKBKB O14920 1/20 0.33
LIMK1 P53667 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
THPO P40225 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32

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
SCHEMBL6563535 0.97 POLB (0.33) POLBIKBKBLIMK1KDM4EGMNN
SCHEMBL9563941 0.94 POLB (0.35) POLBKDM4EGMNNUSP2ALDH1A1
SCHEMBL3664084 0.91 LMNA (0.32) POLBLMNA
SCHEMBL13041036 0.89 POLB (0.33) POLBKDM4EALDH1A1LMNATP53
SCHEMBL3660895 0.89
Methyl Alcohol SCHEMBL20552308 0.87 LMNA (0.33) POLBKDM4ELMNA
SCHEMBL6391691 0.87 LMNA (0.40) LMNA
SCHEMBL14958982 0.83 ALDH1A1 (0.37) POLBKDM4EALDH1A1LMNAGLA
SCHEMBL8147240 0.82 POLB (0.41) POLBKDM4EGMNNUSP2ALDH1A1
SCHEMBL9180929 0.82 LMNA (0.35) LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0484328-B1 PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS MALLINCKRODT INC (US) 1995-06-14 EP claimed
US-5191119-A Process for producing non-ionic radiographic contrast media utilizing N-allylation COOK IMAGING CORP. (US) 1993-03-02 US claimed
EP-0484328-A1 PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-N-ALKYLISOPHTHALAMIC ACID AND 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS. MALLINCKRODT INC (US) 1992-05-13 EP claimed
US-5013865-A X-ray contrast media, controlled stoichiometry and kinetics MALLINCKRODT, INC. (US) 1991-05-07 US claimed
WO-1991001296-A1 PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-N-ALKYLISOPHTHALAMIC ACID AND 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS MALLINCKRODT, INC. (US) 1991-02-07 WO claimed
EP-2975021-B1 PROCESS FOR THE PREPARATION OF IOPAMIDOL BRACCO IMAGING SPA (IT) 2017-07-26 EP disclosed
EP-1353899-B1 A PROCESS FOR THE PREPARATION OF IOPAMIDOL BRACCO IMAGING SPA (IT) 2016-01-20 EP disclosed
EP-2975021-A1 PROCESS FOR THE PREPARATION OF IOPAMIDOL Bracco Imaging SPA (IT) 2016-01-20 EP disclosed
US-7368101-B2 Process for the preparation of iopamidol and the new intermediates therein BRACCO IMAGING S.P.A. (IT) 2008-05-06 US disclosed
EP-0983227-B1 PREPARATION OF TRI-IODO BENZENE COMPOUNDS AMERSHAM HEALTH AS (NO) 2006-08-30 EP disclosed
US-20060106253-A1 Process for the preparation of iopamidol and the new intermediates therein BRACCO IMAGING S.P.A. (IT) 2006-05-18 US disclosed
US-7034183-B2 Process for the preparation of iopamidol and the new intermediated therein BRACCO IMAGING S.P.A. (IT) 2006-04-25 US disclosed
US-5013865-A X-ray contrast media, controlled stoichiometry and kinetics MALLINCKRODT, INC. (US) 1991-05-07 US disclosed
WO-1991001296-A1 PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-N-ALKYLISOPHTHALAMIC ACID AND 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS MALLINCKRODT, INC. (US) 1991-02-07 WO disclosed
WO-1991001296-A1 PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-N-ALKYLISOPHTHALAMIC ACID AND 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS MALLINCKRODT, INC. (US) 1991-02-07 WO disclosed
EP-0406992-A2 New non-ionic carboxamide contrast agent SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-09 EP disclosed
EP-0160036-A4 NOVEL SYNTHETIC METHODS FOR NON-IONIC RADIOGRAPHIC CONTRAST MEDIA. BIOPHYSICA FOUNDATION (US) 1987-06-11 EP disclosed
EP-0177414-A1 Jodized triaminobenzene compounds, process for their preparation and their use in contrast products GUERBET S.A. (FR) 1986-04-09 EP disclosed
EP-0160036-A1 NOVEL SYNTHETIC METHODS FOR NON-IONIC RADIOGRAPHIC CONTRAST MEDIA BIOPHYSICA FOUNDATION (US) 1985-11-06 EP disclosed
WO-1985001727-A1 NOVEL SYNTHETIC METHODS FOR NON-IONIC RADIOGRAPHIC CONTRAST MEDIA BIOPHYSICA FOUNDATION (US) 1985-04-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060106253-A1 Process for the preparation of iopamidol and the new intermediates therein C9, CBR3, INSR POLB 3066/4885IKBKB 900/4885LIMK1 4749/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.