SCHEMBL5186207

SCHEMBL5186207

CC(c1ccc(Nc2ncc(-c3ccccc3)o2)cc1)S(N)(=O)=O

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.68
FLT1 P17948 11/20 0.68
FLT4 P35916 10/20 0.68
VCP P55072 2/20 0.57
ROCK1 Q13464 1/20 0.49
PRKAB2 O43741 2/20 0.48
SRC P12931 2/20 0.48
FLT3 P36888 2/20 0.48
PRKAG1 P54619 2/20 0.48
PRKAA2 P54646 2/20 0.48
PRKAA1 Q13131 2/20 0.48
MKNK1 Q9BUB5 2/20 0.48
PRKAG3 Q9UGI9 2/20 0.48
PRKAG2 Q9UGJ0 2/20 0.48
PRKAB1 Q9Y478 2/20 0.48
LCK P06239 1/20 0.48
RPS6KA1 Q15418 1/20 0.48
IMPDH2 P12268 3/20 0.47
EPHA2 P29317 1/20 0.47

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
Gw572399X SCHEMBL31060985 0.81 KDR (1.00) KDRFLT1FLT4VCPROCK1
Gw549390X SCHEMBL3295009 0.77 KDR (1.00) KDRFLT1FLT4VCPROCK1
SCHEMBL5469435 0.76 KDR (0.64) KDRFLT1FLT4VCPROCK1
SCHEMBL5477380 0.76 KDR (0.71) KDRFLT1FLT4VCPROCK1
SCHEMBL5186212 0.74 KDR (0.61) KDRFLT1FLT4VCPROCK1
SCHEMBL15878912 0.74 KDR (0.79) KDRFLT1FLT4VCPROCK1
SCHEMBL5319681 0.72 VCP (0.65) KDRFLT1FLT4VCPROCK1
SCHEMBL6329220 0.70 KDR (0.79) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5473057 0.69 KDR (0.76) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5185601 0.69 KDR (0.68) KDRFLT1FLT4VCPROCK1

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-1551813-A4 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-07-11 EP claimed
EP-1551813-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2005-07-13 EP claimed
WO-2004032882-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-04-22 WO claimed