SCHEMBL8720205

SCHEMBL8720205

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

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
LMNA P02545 2/20 0.34
TYMP P19971 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
SCHEMBL29665118 0.88 CYP2C19 (0.36) CYP2C19HIF1ALMNATYMP
SCHEMBL7056057 0.88 CYP2C19 (0.36) CYP2C19HIF1ALMNATYMP
SCHEMBL13844908 0.83 CYP2C19 (0.39) CYP2C19HIF1ALMNATYMP
SCHEMBL29665117 0.82 CYP2C19 (0.35) CYP2C19HIF1ALMNA
SCHEMBL622008 0.82 CYP2C19 (0.35) CYP2C19HIF1ALMNA
SCHEMBL8824734 0.81 CYP2C19 (0.32) CYP2C19HIF1ALMNATYMP
SCHEMBL9736246 0.81 CYP2C19 (0.45) CYP2C19HIF1ALMNA
SCHEMBL5162293 0.81 LMNA (0.47) CYP2C19HIF1ALMNA
SCHEMBL7607980 0.81 LMNA (0.47) CYP2C19HIF1ALMNA
SCHEMBL1048643 0.81 LMNA (0.44) CYP2C19HIF1ALMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0662004-B1 USE OF PERSISTENT FREE-RADICALS IN MAGNETIC RESONANCE IMAGING NYCOMED INNOVATION AB (SE) 1998-03-18 EP disclosed
US-5700448-A Use of persistent free-radicals in magnetic resonance imaging NYCOMED IMAGING AS (NO) 1997-12-23 US disclosed
US-5435991-A Use of persistent heterocyclic free-radicals in magnetic resonance imaging NYCOMED INNOVATION AB (SE) 1995-07-25 US disclosed
EP-0662004-A1 USE OF PERSISTENT FREE-RADICALS IN MAGNETIC RESONANCE IMAGING Nycomed Innovation AB (SE) 1995-07-12 EP disclosed
WO-1993002710-A2 USE OF PERSISTENT FREE RADICALS IN MAGNETIC RESONANCE IMAGING NYCOMED INNOVATION AB (SE) 1993-02-18 WO disclosed
WO-1993002711-A1 USE OF PERSISTENT FREE-RADICALS IN MAGNETIC RESONANCE IMAGING NYCOMED INNOVATION AB (SE) 1993-02-18 WO disclosed