SCHEMBL13247484

SCHEMBL13247484

CN(CC(O)O)C(=O)c1c(I)c(NC(=O)C(O)CO)c(I)c(C(=O)NCCCCN(CCCNC(=O)c2c(I)c(NC(=O)C(O)CO)c(I)c(C(=O)N(C)CC(O)CO)c2I)C(=O)c2c(I)c(NC(=O)C(O)CO)c(I)c(C(=O)N(C)CC(O)CO)c2I)c1I

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 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
SCHEMBL13247374 0.97 LMNA (0.55) LMNACYP2C19HIF1A
SCHEMBL13247369 0.95 LMNA (0.56) LMNACYP2C19HIF1A
SCHEMBL3064042 0.94 LMNA (0.55) LMNACYP2C19HIF1A
SCHEMBL13247516 0.94 LMNA (0.55) LMNACYP2C19HIF1A
SCHEMBL3057397 0.92 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL3052814 0.91 LMNA (0.59) LMNACYP2C19HIF1A
SCHEMBL3070022 0.91 LMNA (0.59) LMNACYP2C19HIF1A
SCHEMBL13247600 0.90 LMNA (0.58) LMNACYP2C19HIF1A
SCHEMBL13247366 0.90 LMNA (0.58) LMNACYP2C19HIF1A
SCHEMBL9976303 0.90 LMNA (0.60) LMNACYP2C19HIF1A

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-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

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-20100189656-A1 CONTRAST AGENTS IPO4, TPO, IPO11 LMNA 1835/4885CYP2C19 4234/4885HIF1A 1213/4885

“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.