SCHEMBL5737699

SCHEMBL5737699

C[C@@](O)(C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1Cl)C(F)(F)F

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 1/20 0.81
PDK1 Q15118 19/20 0.69
PDK2 Q15119 19/20 0.69
PDK3 Q15120 19/20 0.69
PDK4 Q16654 19/20 0.69

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
SCHEMBL5735395 0.92 PTGES2 (0.69) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5738123 0.90 PDK1 (0.75) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL3785994 0.89 PTGES2 (1.00) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5748675 0.89 PTGES2 (0.74) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL7804491 0.89 PDK1 (0.72) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5736543 0.89 PTGES2 (0.64) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5737078 0.88 PTGES2 (0.70) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5738110 0.88 PTGES2 (0.72) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5738271 0.87 PDK1 (0.69) PTGES2PDK1PDK2PDK3PDK4
SCHEMBL5738872 0.86 PTGES2 (0.71) PTGES2PDK1PDK2PDK3PDK4

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