SCHEMBL5322309

SCHEMBL5322309

COC(=O)Nc1ccc(Nc2ncc(-c3ccc(Cl)cc3)o2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCP P55072 7/20 0.67
PIK3CG P48736 2/20 0.54
SIRT7 Q9NRC8 1/20 0.52
FLT1 P17948 6/20 0.48
KDR P35968 6/20 0.48
FLT4 P35916 5/20 0.48
DGAT1 O75907 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PRKAB2 O43741 1/20 0.44
LCK P06239 1/20 0.44
SRC P12931 1/20 0.44
FLT3 P36888 1/20 0.44
PRKAG1 P54619 1/20 0.44
PRKAA2 P54646 1/20 0.44
PRKAA1 Q13131 1/20 0.44
RPS6KA1 Q15418 1/20 0.44
MKNK1 Q9BUB5 1/20 0.44
PRKAG3 Q9UGI9 1/20 0.44
PRKAG2 Q9UGJ0 1/20 0.44

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
SCHEMBL5317562 0.89 VCP (0.61) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL5319681 0.88 VCP (0.65) VCPFLT1KDRFLT4
SCHEMBL5319705 0.82 VCP (0.69) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL14466947 0.82 VCP (0.65) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL28733638 0.81 VCP (0.60) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL14465944 0.80 VCP (1.00) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL14466945 0.78 VCP (0.74) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL21303773 0.77 VCP (0.62) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL28733778 0.77 VCP (0.64) VCPPIK3CGSIRT7FLT1KDR
SCHEMBL5319878 0.77 FLT1 (0.76) VCPSIRT7FLT1KDRFLT4

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-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO claimed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed