SCHEMBL5334570

SCHEMBL5334570

COCCOc1ccc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)cc1OCCOC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
PRKCQ Q04759 1/20 0.42
TNIK Q9UKE5 1/20 0.42
MAOB P27338 2/20 0.41
RET P07949 1/20 0.41
PIK3CA P42336 1/20 0.40
ROCK2 O75116 2/20 0.39
IGF1R P08069 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
ROCK1 Q13464 1/20 0.39
PRKG1 Q13976 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
S1PR1 P21453 1/20 0.39
IMPDH2 P12268 2/20 0.39
PRKD3 O94806 1/20 0.39
MET P08581 1/20 0.39
SYK P43405 1/20 0.39

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
SCHEMBL5340755 0.97 KDR (0.42) KDRFLT1FLT4PRKCQTNIK
SCHEMBL5318108 0.96 FLT1 (0.50) KDRFLT1FLT4PRKCQTNIK
SCHEMBL5340799 0.94 FLT1 (0.48) KDRFLT1FLT4PRKCQTNIK
SCHEMBL5339756 0.94 FLT1 (0.48) KDRFLT1FLT4PRKCQTNIK
SCHEMBL14466982 0.93 KDR (0.39) KDRFLT1FLT4PRKCQTNIK
SCHEMBL5333896 0.89 KDR (0.44) KDRFLT1FLT4TNIKRET
SCHEMBL5341184 0.89 FLT1 (0.50) KDRFLT1FLT4TNIKMAOB
SCHEMBL14466940 0.88 KDR (0.49) KDRFLT1FLT4TNIKMAOB
SCHEMBL5344443 0.87 KDR (0.59) KDRFLT1FLT4TNIKMAOB
SCHEMBL5334189 0.86 FLT1 (0.52) KDRFLT1FLT4TNIKMAOB

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