SCHEMBL2764077

SCHEMBL2764077

O=CNc1c(I)c(C(=O)NCCO)c(I)c(C(=O)NC(CO)CO)c1I

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 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
SCHEMBL8612917 0.90 LMNA (0.58) LMNACYP2C19HIF1A
SCHEMBL8378595 0.85 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL8375497 0.82 LMNA (0.56) LMNACYP2C19HIF1A
SCHEMBL619948 0.82 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL14310826 0.79 LMNA (0.83) LMNACYP2C19HIF1A
SCHEMBL8377985 0.78 LMNA (0.45) LMNACYP2C19HIF1A
SCHEMBL1744064 0.76 LMNA (0.44) LMNACYP2C19HIF1A
SCHEMBL1742159 0.76 LMNA (0.42) LMNACYP2C19HIF1A
SCHEMBL1744046 0.75 LMNA (0.53) LMNACYP2C19HIF1A
SCHEMBL8382143 0.75 LMNA (0.49) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738596-B2 Contrast agents GE HEALTHCARE AS (NO) 2017-08-22 US disclosed
US-20150191422-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2015-07-09 US disclosed
US-8920780-B2 Contrast agents GE HEALTHCARE AS (NO) 2014-12-30 US disclosed
EP-2178568-B1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2014-07-02 EP disclosed
US-20100322868-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-12-23 US disclosed
EP-2178568-A2 CONTRAST AGENTS GE Healthcare AS (NO) 2010-04-28 EP disclosed
WO-2009008734-A2 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2009-01-15 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 (2 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-20150191422-A1 CONTRAST AGENTS SSTR3, INSR, INSRR LMNA 1656/4885CYP2C19 3523/4885HIF1A 1391/4885
US-20100322868-A1 CONTRAST AGENTS SSTR3, INSR, INSRR LMNA 1656/4885CYP2C19 3523/4885HIF1A 1391/4885

“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.