SCHEMBL3795881

SCHEMBL3795881

COc1cc(F)c(F)c(Nc2ccc(I)cc2F)c1NS(=O)(=O)C1CC1c1ccc(F)cc1F

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 16/20 0.52
MAP2K2 P36507 3/20 0.52
CHEK1 O14757 1/20 0.52
MAPK10 P53779 1/20 0.52
PRKAG1 P54619 1/20 0.52
ADCK1 Q86TW2 1/20 0.52
PRKAG2 Q9UGJ0 1/20 0.52
CA2 P00918 3/20 0.39
FLT1 P17948 1/20 0.36
MAPK14 Q16539 2/20 0.35

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
SCHEMBL13063576 0.84 MAP2K1 (0.38) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL685422 0.82 MAP2K1 (0.61) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL387871 0.81 MAP2K1 (0.58) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL3794912 0.80 MAP2K1 (0.41) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL389984 0.78 MAP2K1 (0.62) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL3803379 0.77 MAP2K1 (0.37) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL13063776 0.76 MAP2K1 (0.37) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL3784573 0.76 MAP2K1 (0.46) MAP2K1MAP2K2CA2
SCHEMBL392369 0.75 MAP2K1 (0.47) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL13063593 0.73 MAP2K1 (0.39) MAP2K1MAP2K2CHEK1MAPK10PRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010145197-A1 NOVEL 6-ARYLAMINO PYRIDONE SULFONAMIDES AND 6-ARYLAMINO PYRAZINONE SULFONAMDIES AS MEK INHIBITORS CHEMIZON (BEIJING), LTD. (CN) 2010-12-23 WO disclosed
WO-2010145197-A1 NOVEL 6-ARYLAMINO PYRIDONE SULFONAMIDES AND 6-ARYLAMINO PYRAZINONE SULFONAMDIES AS MEK INHIBITORS CHEMIZON (BEIJING), LTD. (CN) 2010-12-23 WO disclosed