SCHEMBL1870073

SCHEMBL1870073

CCC(c1cccc(-c2nc(N3CCOCC3)sc2-c2ccnc(NCC(C)C)n2)c1F)S(N)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 9/20 0.47
RIPK2 O43353 1/20 0.43
KCNH2 Q12809 1/20 0.40
EGFR P00533 7/20 0.40
LCK P06239 1/20 0.38
LYN P07948 1/20 0.38
TGFBR1 P36897 1/20 0.38
BTK Q06187 1/20 0.38
ACVR2B Q13705 1/20 0.38
ERBB4 Q15303 1/20 0.38
NCOA1 Q15788 1/20 0.38
CDK1 P06493 1/20 0.36
CDK2 P24941 1/20 0.36
MTOR P42345 1/20 0.36
SMG1 Q96Q15 1/20 0.36

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
SCHEMBL1874594 0.89 BRAF (0.43) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL1875729 0.88 BRAF (0.42) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL1872504 0.87 BRAF (0.42) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL1875785 0.86 BRAF (0.40) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL2196398 0.83 BRAF (0.64) BRAFRIPK2LCKLYNTGFBR1
SCHEMBL1866903 0.82 RIPK2 (0.40) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL2194736 0.82 BRAF (0.53) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL2194829 0.81 BRAF (0.55) BRAFRIPK2KCNH2EGFRLCK
SCHEMBL12350507 0.80 BRAF (0.55) BRAFRIPK2LCKLYNTGFBR1
SCHEMBL1870361 0.80 RIPK2 (0.40) BRAFRIPK2KCNH2EGFRLCK

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