SCHEMBL1554650

SCHEMBL1554650

NS(=O)(=O)Nc1c(F)cc(NS(=O)(=O)C2CC2)c(O)c1Nc1ccc(I)cc1F

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.44
MAP2K2 P36507 3/20 0.42
CA2 P00918 7/20 0.42
CA1 P00915 1/20 0.37

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
SCHEMBL391025 0.80 MAP2K1 (0.47) MAP2K1MAP2K2CA2
SCHEMBL391574 0.78 MAP2K1 (0.53) MAP2K1MAP2K2CA2
SCHEMBL387833 0.73 MAP2K1 (0.51) MAP2K1MAP2K2CA2
SCHEMBL392673 0.73 MAP2K1 (0.50) MAP2K1MAP2K2CA2
SCHEMBL10251094 0.71 MAP2K1 (0.48) MAP2K1MAP2K2CA2
SCHEMBL1516527 0.71 MAP2K1 (0.45) MAP2K1MAP2K2
SCHEMBL486695 0.70 MAP2K1 (0.57) MAP2K1MAP2K2
SCHEMBL685422 0.70 MAP2K1 (0.61) MAP2K1MAP2K2CA2
SCHEMBL720442 0.70 MAP2K1 (0.51) MAP2K1MAP2K2
SCHEMBL2295064 0.70 MAP2K1 (0.57) MAP2K1MAP2K2

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
EP-2491015-A1 SUBSTITUTED BENZOSULPHONAMIDES Bayer Pharma Aktiengesellschaft (DE) 2012-08-29 EP disclosed
WO-2011047788-A1 SUBSTITUTED BENZOSULPHONAMIDES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-04-28 WO disclosed