SCHEMBL9515975

SCHEMBL9515975

CC(=O)OCC(CNC(=O)c1c(I)c(N)c(I)c(N)c1I)OC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.37
LMNA P02545 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
AR P10275 1/20 0.32
GAA P10253 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
SCHEMBL1359798 0.97 LMNA (0.38) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL28880448 0.94 LMNA (0.36) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8063052 0.93 LMNA (0.36) ABCB1LMNACYP2C19HIF1ATDP1
Hydrochloric Acid SCHEMBL8857263 0.92 LMNA (0.35) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL9009046 0.92 LMNA (0.35) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL7587993 0.91 ABCB1 (0.34) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8374103 0.91 LMNA (0.34) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8377049 0.90 LMNA (0.36) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL4927394 0.90 LMNA (0.38) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8378374 0.90 LMNA (0.34) ABCB1LMNACYP2C19HIF1ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0357467-B1 Non-ionic tri-iodobenzene compounds, and contrast agents containing same GUERBET SA (FR) 1993-12-08 EP disclosed
US-5043152-A Radiography GUERBET S.A. (FR) 1991-08-27 US disclosed
EP-0357467-A1 Non-ionic tri-iodobenzene compounds, and contrast agents containing same GUERBET S.A. (FR) 1990-03-07 EP disclosed