SCHEMBL3067992

SCHEMBL3067992

O=C(CO)Nc1c(I)c(C(=O)NCCCNC(=O)c2c(I)c(NC(=O)CO)c(I)c(C(=O)NCC(O)C(O)CO)c2I)c(I)c(C(=O)NCC(O)C(O)CO)c1I

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3062459 0.89 LMNA (0.54) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL3067086 0.86 LMNA (0.56) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL13882422 0.82 LMNA (0.52) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL3068295 0.82 LMNA (0.56) LMNACYP2C19HIF1A
SCHEMBL5030922 0.81 LMNA (0.60) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL13883277 0.81 LMNA (0.50) LMNACYP2C19HIF1A
SCHEMBL9188727 0.81 LMNA (0.56) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL9352754 0.80 LMNA (0.58) LMNACYP2C19HIF1ASMN1; SMN2
SCHEMBL13247494 0.79 LMNA (0.56) LMNACYP2C19HIF1A
SCHEMBL10624509 0.79 LMNA (0.57) LMNACYP2C19HIF1ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100221189-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US claimed
EP-2200656-A1 CONTRAST AGENTS GE Healthcare AS (NO) 2010-06-30 EP claimed
WO-2009047319-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2009-04-16 WO claimed
US-8202511-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-06-19 US disclosed
US-8202511-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-06-19 US disclosed
US-8202511-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-06-19 US disclosed
US-20100221189-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221189-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221189-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 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-20100221189-A1 CONTRAST AGENTS NR1I3, NR1I2, NR1D2 LMNA 2753/4885CYP2C19 754/4885HIF1A 612/4885

“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.