SCHEMBL1869185

SCHEMBL1869185

NS(=O)(=O)C(CC(F)(F)F)c1cccc(-c2nc(C3CCNCC3)sc2-c2ccnc(Cl)n2)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.40
KCNH2 Q12809 6/20 0.40
NR1I2 O75469 2/20 0.37
ACHE P22303 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
SCHEMBL1871922 0.91 BRAF (0.37) BRAFNR1I2
SCHEMBL12230869 0.90 BRAF (0.40) BRAFKCNH2NR1I2ACHE
SCHEMBL1871286 0.85 BRAF (0.42) BRAFNR1I2
SCHEMBL1877503 0.84 BRAF (0.41) BRAFNR1I2
SCHEMBL12230891 0.84 BRAF (0.45) BRAFKCNH2NR1I2
SCHEMBL1875091 0.84 BRAF (0.46) BRAFKCNH2NR1I2ACHE
SCHEMBL1874474 0.82 BRAF (0.45) BRAFNR1I2
SCHEMBL1872280 0.80 EGFR (0.38) BRAFNR1I2
SCHEMBL12230902 0.80 EGFR (0.43) BRAFKCNH2NR1I2
SCHEMBL1866713 0.79 EGFR (0.34) BRAFNR1I2

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-2498608-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GlaxoSmithKline LLC (US) 2012-09-19 EP disclosed
WO-2011059610-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-05-19 WO disclosed