SCHEMBL9853840

SCHEMBL9853840

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

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.74
SMN1; SMN2 Q16637 1/20 0.32
MAP2K1 Q02750 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
SCHEMBL17264622 0.88 LMNA (0.83) LMNASMN1; SMN2MAP2K1
Iopamidol SCHEMBL471484 0.85 LMNA (1.00) LMNASMN1; SMN2
Iopamidol SCHEMBL7101453 0.85 LMNA (1.00) LMNASMN1; SMN2
Iopamidol SCHEMBL27781 0.85 LMNA (1.00) LMNASMN1; SMN2
SCHEMBL15760478 0.83 LMNA (0.67) LMNASMN1; SMN2MAP2K1
SCHEMBL8978151 0.83 LMNA (0.71) LMNASMN1; SMN2MAP2K1
Iopamidol SCHEMBL2140144 0.81 LMNA (0.92) LMNASMN1; SMN2
SCHEMBL22006124 0.81 LMNA (0.92) LMNASMN1; SMN2
Iopamidol SCHEMBL3424448 0.81 LMNA (0.92) LMNASMN1; SMN2
SCHEMBL13283626 0.80 LMNA (0.90) LMNASMN1; SMN2

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-0437144-A1 Non-ionic iodinated compounds, procedure for their preparation and contrast agents containing them GUERBET S.A. (FR) 1991-07-17 EP claimed