SCHEMBL17296647

SCHEMBL17296647

COCN(c1cccc(-c2nc(C3CCN(C(=O)OCc4ccccc4)CC3)sc2-c2ccnc(NC(C)=O)c2)c1F)S(=O)(=O)c1cc(F)ccc1F

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.57
NR1I2 O75469 4/20 0.46
EGFR P00533 1/20 0.37
RAF1 P04049 1/20 0.37
ERBB2 P04626 1/20 0.37
SRC P12931 1/20 0.37
KDR P35968 1/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
TRPC3 Q13507 1/20 0.35
TRPC7 Q9HCX4 1/20 0.35
PIK3C3 Q8NEB9 3/20 0.34
MAPK14 Q16539 4/20 0.33
GRIN2B Q13224 2/20 0.33
GSK3B P49841 1/20 0.32
MAPK10 P53779 1/20 0.32

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
SCHEMBL12482309 0.94 BRAF (0.50) BRAFNR1I2EGFRRAF1ERBB2
SCHEMBL17296642 0.92 BRAF (0.46) BRAFNR1I2EGFRRAF1ERBB2
SCHEMBL17296648 0.92 BRAF (0.45) BRAFNR1I2EGFRRAF1ERBB2
SCHEMBL17296645 0.89 BRAF (0.72) BRAFNR1I2EGFRRAF1ERBB2
SCHEMBL12482635 0.88 BRAF (0.43) BRAFNR1I2EGFRRAF1ERBB2
SCHEMBL17296644 0.88 BRAF (0.60) BRAFNR1I2EGFRRAF1ERBB2
SCHEMBL17685154 0.88 BRAF (0.60) BRAFNR1I2PIK3C3MAPK14
SCHEMBL12482316 0.82 TRPC3 (0.41) TRPC3TRPC7GRIN2B
SCHEMBL17296646 0.82 BRAF (0.50) BRAFNR1I2RAF1PIK3C3MAPK14
SCHEMBL17296636 0.82 BRAF (0.46) 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 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