SCHEMBL9009065

SCHEMBL9009065

CNCC(=O)Nc1c(I)c(C(=O)NC(CO)C(O)CO)c(I)c(C(=O)NC(CO)C(O)CO)c1I

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.43
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9009198 0.86 LMNA (0.49) LMNASMN1; SMN2
SCHEMBL9009240 0.84 LMNA (0.53) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL29962850 0.81 LMNA (0.49) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL9009059 0.81 LMNA (0.48) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL9352694 0.80 LMNA (0.47) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL7590713 0.80 LMNA (0.42) LMNASMN1; SMN2
SCHEMBL9842902 0.79 LMNA (0.44) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL9009330 0.79 LMNA (0.63) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL9009257 0.79 LMNA (0.63) LMNASMN1; SMN2CYP2C19HIF1A
SCHEMBL9352669 0.78 LMNA (0.42) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0571593-B1 NEW NON IONIC IODIZED AGENTS FOR X-RAY CONTRASTING, METHOD FOR PREPARING THEM AND GALENICAL COMPOSITIONS CONTAINING THEM INVEST JUSTESA IMAGEN S A CENT (ES) 1996-10-30 EP disclosed