SCHEMBL3024600

SCHEMBL3024600

CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(=O)Nc1c(I)c(C(=O)Cl)c(I)c(C(=O)NCC(O)CO)c1I

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
CYP2C19 P33261 1/20 0.43
HIF1A Q16665 1/20 0.43
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
ABCB1 P08183 1/20 0.34
PGD P52209 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL3020429 0.88 LMNA (0.46) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL3026389 0.88 POLB (0.42) LMNAPOLBMAPK1ABCB1PGD
SCHEMBL9356454 0.85 LMNA (0.48) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL3019886 0.85 LMNA (0.39) LMNACYP2C19HIF1APOLBMAPK1
SCHEMBL711738 0.85 POLB (0.35) LMNAPOLBMAPK1ABCB1PGD
SCHEMBL3030371 0.84 LMNA (0.49) LMNACYP2C19HIF1APOLBMAPK1
SCHEMBL3024742 0.84 POLB (0.40) LMNAPOLBMAPK1PGDTDP1
SCHEMBL9451103 0.81 LMNA (0.59) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL9352729 0.81 LMNA (0.59) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL3029790 0.80 POLB (0.36) LMNAPOLBMAPK1PGDTDP1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2200971-B1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2013-04-24 EP disclosed
EP-2200655-B1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2012-07-18 EP disclosed
US-20100221192-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221192-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221192-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100209356-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-08-19 US disclosed
US-20100209356-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-08-19 US disclosed
US-20100209356-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-08-19 US disclosed
US-20100189656-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-07-29 US disclosed
US-20100189656-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-07-29 US disclosed
US-20100189656-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-07-29 US disclosed
EP-2200971-A1 CONTRAST AGENTS GE Healthcare AS (NO) 2010-06-30 EP disclosed
WO-2009047316-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2009-04-16 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 (3 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-20100189656-A1 CONTRAST AGENTS IPO4, TPO, IPO11 LMNA 1835/4885CYP2C19 4234/4885HIF1A 1213/4885
US-20100209356-A1 CONTRAST AGENTS C5, C1S, C1R LMNA 2073/4885CYP2C19 2427/4885HIF1A 509/4885
US-20100221192-A1 CONTRAST AGENTS C5, C1S, C1R LMNA 1840/4885CYP2C19 2570/4885HIF1A 1051/4885

“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.