SCHEMBL5738271

SCHEMBL5738271

Cc1ccc(Cl)c(NS(=O)(=O)c2ccc(NC(=O)[C@@](C)(O)C(F)(F)F)c(Cl)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 18/20 0.69
PDK2 Q15119 18/20 0.69
PDK3 Q15120 18/20 0.69
PDK4 Q16654 18/20 0.69
PTGES2 Q9H7Z7 1/20 0.68
NR1H2 P55055 1/20 0.61
NR1H3 Q13133 1/20 0.61

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
SCHEMBL5737922 0.88 PDK1 (0.68) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5737699 0.87 PTGES2 (0.81) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5738123 0.86 PDK1 (0.75) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5737489 0.85 PTGES2 (0.66) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5738183 0.84 PDK1 (0.68) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5737078 0.84 PTGES2 (0.70) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL6357232 0.84 NR1H2 (0.65) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5738060 0.84 PDK1 (0.62) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL4608280 0.83 PDK1 (0.74) PDK1PDK2PDK3PDK4PTGES2
SCHEMBL5736308 0.83 PDK1 (0.77) PDK1PDK2PDK3PDK4PTGES2

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-1064274-B1 BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEDICAMENTS ASTRAZENECA AB (SE) 2006-04-19 EP disclosed