SCHEMBL16803249

SCHEMBL16803249

CC1=CNNc2c1cc(NS(=O)(=O)C1(CCO)CC1)c(Nc1ccc(Cl)cc1Cl)c2F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.32
MAP2K2 P36507 1/20 0.32
MAPK10 P53779 1/20 0.32
PRKAG1 P54619 1/20 0.32
MAP2K1 Q02750 1/20 0.32
ADCK1 Q86TW2 1/20 0.32
PRKAG2 Q9UGJ0 1/20 0.32
CNR2 P34972 1/20 0.30
LMNA P02545 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
SCHEMBL16803245 0.82 BRAF (0.37) CNR2
SCHEMBL1342335 0.75 CSF1R (0.32) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL19050836 0.69 MAP2K1 (0.45) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL14016189 0.68 MAP2K1 (0.36) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL391581 0.65 MAP2K1 (0.55) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL9995002 0.64 MAP2K1 (0.44) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL13114870 0.64 MAP2K1 (0.37) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL12763595 0.63 MAP2K1 (0.39) MAP2K2MAP2K1
SCHEMBL1516492 0.63 MAP2K1 (0.38) CHEK1MAP2K2MAPK10PRKAG1MAP2K1
SCHEMBL1516555 0.63 MAP2K1 (0.42) MAP2K2MAP2K1

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-2121620-B1 INHIBITORS OF MEK ARDEA BIOSCIENCES INC (US) 2015-06-17 EP disclosed