SCHEMBL11588043

SCHEMBL11588043

CC(=O)Nc1c(I)c(NC(=O)CN)c(I)c(C(=O)O)c1I

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.59
SMN1; SMN2 Q16637 1/20 0.53
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
HPGD P15428 1/20 0.30
PTPRB P23467 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL11387512 0.88 TSHR (0.47) LMNASMN1; SMN2TSHRMAPK1CA1
Diatrizoic Acid SCHEMBL7615048 0.88 LMNA (0.67) LMNASMN1; SMN2TSHRMAPK1HPGD
Diatrizoic Acid SCHEMBL8508 0.88 LMNA (0.67) LMNASMN1; SMN2TSHRMAPK1HPGD
SCHEMBL8494612 0.87 LMNA (0.59) LMNASMN1; SMN2TSHRMAPK1HPGD
Ioxotrizoic Acid SCHEMBL37821 0.87 LMNA (0.59) LMNASMN1; SMN2TSHRMAPK1HPGD
Ioxotrizoic Acid SCHEMBL28324440 0.87 LMNA (0.59) LMNASMN1; SMN2TSHRMAPK1HPGD
Diatrizoic Acid SCHEMBL1197801 0.86 LMNA (0.65) LMNASMN1; SMN2TSHRMAPK1HPGD
Diatrizoic Acid SCHEMBL30451079 0.86 LMNA (0.65) LMNASMN1; SMN2TSHRMAPK1HPGD
Diatrizoic Acid SCHEMBL8509 0.86 LMNA (0.65) LMNASMN1; SMN2TSHRMAPK1HPGD
Diatrizoic Acid SCHEMBL3974126 0.86 LMNA (0.65) LMNASMN1; SMN2TSHRMAPK1HPGD

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
US-4107286-A Polyiods benzene derivatives and X-ray contrast media containing the same GUERBET S.A. (FR) 1978-08-15 US disclosed