SCHEMBL17296646

SCHEMBL17296646

COCN(c1cccc(-c2nc(C(C)(C)C)sc2-c2ccnc(NC(C)=O)c2)c1F)S(=O)(=O)c1cc(F)ccc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.50
PIK3C3 Q8NEB9 13/20 0.40
NR1I2 O75469 3/20 0.39
MAPK14 Q16539 1/20 0.38
PLK4 O00444 1/20 0.36
EPHB6 O15197 1/20 0.36
RIPK2 O43353 1/20 0.36
JAK2 O60674 1/20 0.36
ULK1 O75385 1/20 0.36
ERN1 O75460 1/20 0.36
PRKD3 O94806 1/20 0.36
ABL1 P00519 1/20 0.36
KRAS P01116 1/20 0.36
RAF1 P04049 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
CDK1 P06493 1/20 0.36
YES1 P07947 1/20 0.36
LYN P07948 1/20 0.36
MET P08581 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
SCHEMBL17296640 0.87 BRAF (0.43) BRAFNR1I2MAPK14PLK4EPHB6
SCHEMBL17296644 0.86 BRAF (0.60) BRAFPIK3C3NR1I2MAPK14RAF1
SCHEMBL17685154 0.86 BRAF (0.60) BRAFPIK3C3NR1I2MAPK14
SCHEMBL17296645 0.85 BRAF (0.72) BRAFPIK3C3NR1I2MAPK14RAF1
SCHEMBL17296647 0.82 BRAF (0.57) BRAFPIK3C3NR1I2MAPK14RAF1
SCHEMBL17297141 0.82 BRAF (0.71) BRAFPIK3C3NR1I2PLK4EPHB6
SCHEMBL17296643 0.80 BRAF (0.51) BRAFPIK3C3NR1I2MAPK14RAF1
SCHEMBL17297171 0.79 BRAF (0.51) BRAFNR1I2RAF1
SCHEMBL17296632 0.78 BRAF (0.35) BRAFNR1I2MAPK14
SCHEMBL17296630 0.77 BRAF (0.37) BRAFNR1I2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2678336-B1 THIAZOLYLPHENYL-BENZENESULFONAMIDO DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2016-04-20 EP disclosed
US-9199979-B2 Thiazolylphenyl-benzenesulfonamido derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-12-01 US disclosed
US-9199979-B2 Thiazolylphenyl-benzenesulfonamido derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-12-01 US disclosed