SCHEMBL5336680

SCHEMBL5336680

c1ccc(-c2ccc(-c3cnc(Nc4ccc5[nH]ncc5c4)o3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 5/20 0.59
KDR P35968 10/20 0.57
FLT1 P17948 10/20 0.57
FLT4 P35916 9/20 0.57
DYRK3 O43781 1/20 0.55
CLK1 P49759 1/20 0.55
CLK2 P49760 1/20 0.55
CLK3 P49761 1/20 0.55
GSK3B P49841 1/20 0.55
CDK5 Q00535 1/20 0.55
DYRK1A Q13627 1/20 0.55
CDK5R1 Q15078 1/20 0.55
DYRK2 Q92630 1/20 0.55
CLK4 Q9HAZ1 1/20 0.55
DYRK1B Q9Y463 1/20 0.55
VCP P55072 1/20 0.54
ROCK1 Q13464 1/20 0.52
PIK3CA P42336 1/20 0.48
EGFR P00533 1/20 0.48

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
SCHEMBL14465941 0.98 IMPDH2 (0.61) IMPDH2KDRFLT1FLT4DYRK3
SCHEMBL5319685 0.88 IMPDH2 (0.54) IMPDH2KDRFLT1FLT4DYRK3
SCHEMBL5333205 0.88 IMPDH2 (0.53) IMPDH2KDRFLT1FLT4VCP
SCHEMBL5343891 0.88 VCP (0.58) IMPDH2KDRFLT1FLT4CLK2
SCHEMBL5333863 0.88 VCP (0.58) IMPDH2KDRFLT1FLT4VCP
SCHEMBL5336433 0.88 MKNK1 (0.51) IMPDH2KDRFLT1FLT4VCP
SCHEMBL5335613 0.88 CDC7 (0.58) IMPDH2KDRFLT1FLT4VCP
SCHEMBL5316809 0.88 NOS1 (0.48) IMPDH2KDRFLT1FLT4CLK4
SCHEMBL14465936 0.88 IMPDH2 (0.61) IMPDH2KDRFLT1FLT4VCP
SCHEMBL5342613 0.86 VCP (0.50) IMPDH2KDRFLT1FLT4DYRK3

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