SCHEMBL7591166

SCHEMBL7591166

Nc1c(I)c(N)c(I)c(CC(O)CO)c1I

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
PDE4A P27815 1/20 0.30
ADRA1A P35348 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
HIF1A Q16665 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
SCHEMBL29032606 0.77
SCHEMBL2011398 0.74 LMNA (0.33) LMNAHIF1A
SCHEMBL7595632 0.71
SCHEMBL27830279 0.70 TSHR (0.33) LMNAALDH1A1CYP1A2
SCHEMBL381204 0.70 TDP1 (0.38) LMNAALDH1A1CHRM1TBXA2RPDE4A
Formamide SCHEMBL22804655 0.69
SCHEMBL7589511 0.68
SCHEMBL7592100 0.67
SCHEMBL28192713 0.67 TTR (0.39) LMNAALDH1A1
SCHEMBL9755618 0.63

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-6448442-B1 X-RAY CONTRAST AGENTS; LOW VISCOSITY IODINATED ARYL COMPOUNDS AMERSHAM HEALTH AS (NO) 2002-09-10 US disclosed