SCHEMBL10072145

SCHEMBL10072145

C=CCN(C)C(=O)c1c(I)c(NC(=O)C(OC(C)=O)C(COC(C)=O)OC(C)=O)c(I)c(C(=O)I)c1I

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
PGD P52209 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
SCHEMBL718786 0.94 POLB (0.34) POLBMAPK1LMNATDP1PGD
SCHEMBL10044837 0.88 LMNA (0.36) POLBMAPK1LMNA
SCHEMBL10044841 0.86 LMNA (0.35) POLBMAPK1LMNA
SCHEMBL709410 0.82 LMNA (0.33) LMNA
SCHEMBL14435464 0.81 POLB (0.37) POLBMAPK1TDP1PGD
SCHEMBL13247467 0.79 LMNA (0.49) POLBMAPK1LMNATDP1PGD
SCHEMBL3026389 0.78 POLB (0.42) POLBMAPK1LMNATDP1PGD
SCHEMBL3030371 0.78 LMNA (0.49) POLBMAPK1LMNATDP1
SCHEMBL10044849 0.77 LMNA (0.42) LMNA
SCHEMBL3310580 0.77 LMNA (0.31) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124806-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-02-28 US disclosed
US-20090053142-A1 CONTRAST AGENTS WYNN DUNCAN 2009-02-26 US 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-20090053142-A1 CONTRAST AGENTS IPO4, TPO, IPO11 POLB 2876/4885MAPK1 1809/4885LMNA 2151/4885

“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.