SCHEMBL7589481

SCHEMBL7589481

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

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL7766724 0.82 LMNA (0.46) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL8764364 0.80 TSHR (0.56) LMNATSHRMAPK1
SCHEMBL8727104 0.80 TSHR (0.47) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL7594166 0.78 LMNA (0.33) LMNATSHRMAPK1
Ioxotrizoic Acid SCHEMBL28324440 0.77 LMNA (0.59) LMNATSHRMAPK1SMN1; SMN2
Ioxotrizoic Acid SCHEMBL37821 0.77 LMNA (0.59) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL8374109 0.72 LMNA (0.62) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL15760478 0.72 LMNA (0.67) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL7592516 0.72 LMNA (0.35) LMNASMN1; SMN2
SCHEMBL8377087 0.72 LMNA (0.32) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6448442-B1 X-RAY CONTRAST AGENTS; LOW VISCOSITY IODINATED ARYL COMPOUNDS AMERSHAM HEALTH AS (NO) 2002-09-10 US disclosed
US-6310243-B1 BENZENE COMPOUNDS IN WHICH 3 NON-ADJACENT RING ATOMS ARE SUBSTITUTED WITH IODINE, 2 OF THE REMAINING RING ATOMS ARE AMIDE SUBSTITUTED WITH HYDROXY AND THE OTHER REMAINING RING ATOM IS A NON-AMIDE, HYDROXY-SUBSTITUTED NONIONIC MOIETY NYCOMED IMAGING AS (NO) 2001-10-30 US disclosed
US-5993780-A A POLYIODOARYLALKYL ALCOHOL OR DERIVATIVE NYCOMED IMAGING AS (NO) 1999-11-30 US disclosed
EP-0782564-B1 IODINATED X-RAY CONTRAST MEDIA NYCOMED IMAGING AS (NO) 1999-09-01 EP disclosed
US-5882628-A Contrast media NYCOMED IMAGING AS (NO) 1999-03-16 US disclosed