SCHEMBL4052002

SCHEMBL4052002

COc1cc(-c2c(-c3ccncc3)nn3c(-c4cccc(S(=O)(=O)N(C)C)c4)ccnc23)ccc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.56
MAPT P10636 2/20 0.43
PI4KB Q9UBF8 2/20 0.42
CHEK1 O14757 1/20 0.41
ABL1 P00519 1/20 0.41
PRKCB P05771 1/20 0.41
FYN P06241 1/20 0.41
CDK1 P06493 1/20 0.41
LYN P07948 1/20 0.41
MET P08581 1/20 0.41
HCK P08631 1/20 0.41
SRC P12931 1/20 0.41
PDGFRA P16234 1/20 0.41
PRKCA P17252 1/20 0.41
CDK2 P24941 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
MAP4K2 Q12851 1/20 0.41
ROCK1 Q13464 1/20 0.41
RPS6KA1 Q15418 1/20 0.41
MAPK14 Q16539 1/20 0.41

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
SCHEMBL4053315 0.88 BRAF (0.54) BRAFPI4KBCHEK1ABL1PRKCB
SCHEMBL4058317 0.87 BRAF (0.57) BRAFMAPTCHEK1ABL1PRKCB
SCHEMBL4056069 0.83 BRAF (0.56) BRAFPI4KBCHEK1ABL1PRKCB
SCHEMBL4059789 0.81 BRAF (0.51) BRAFPI4KBCHEK1ABL1PRKCB
SCHEMBL4053209 0.80 BRAF (0.49) BRAFCHEK1ABL1PRKCBFYN
SCHEMBL4052857 0.79 BRAF (0.47) BRAF
SCHEMBL4056272 0.79 BRAF (0.53) BRAFMAPTCHEK1ABL1PRKCB
SCHEMBL4050893 0.78 PI4KB (0.41) BRAFPI4KBCHEK1ABL1PRKCB
SCHEMBL3654978 0.78 BRAF (0.43) BRAFPI4KBCHEK1ABL1PRKCB
SCHEMBL4050676 0.78 BRAF (0.51) BRAFMAPTPI4KBCHEK1ABL1

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
WO-2009111260-A1 PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-11 WO claimed
WO-2009111260-A1 PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-11 WO disclosed