SCHEMBL3919922

SCHEMBL3919922

CNC(=O)c1c(I)c(NC(=O)C(O)C(O)CO)c(I)c(C(N)=O)c1I

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.40
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
SCHEMBL11232628 0.85 LMNA (0.51) LMNASMN1; SMN2CYP2C19HIF1A
Ioglucomide SCHEMBL668426 0.83 SMN1; SMN2 (0.52) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL11523450 0.81 SMN1; SMN2 (0.57) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL11524954 0.80 LMNA (0.46) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL11526793 0.79 LMNA (0.45) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL11224662 0.79 SMN1; SMN2 (0.60) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL11232347 0.78 LMNA (0.44) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL11217136 0.78 SMN1; SMN2 (0.45) LMNASMN1; SMN2
SCHEMBL9239081 0.77 LMNA (0.49) LMNASMN1; SMN2CYP2C19
SCHEMBL13220206 0.76 LMNA (0.50) LMNASMN1; SMN2CYP2C19HIF1A

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
WO-2009005364-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2009-01-08 WO claimed
WO-2009005364-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2009-01-08 WO disclosed