SCHEMBL14607281

SCHEMBL14607281

CCC(C)N(CC)c1ccc(-c2cnc(Nc3ccc(OC)c(OC)c3)o2)cc1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 9/20 0.61
FLT4 P35916 9/20 0.61
KDR P35968 9/20 0.61
IMPDH2 P12268 10/20 0.50
VCP P55072 1/20 0.49

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
SCHEMBL5469678 0.86 FLT1 (0.68) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5464876 0.79 FLT1 (0.77) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5469587 0.78 KDR (0.76) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5319878 0.78 FLT1 (0.76) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5480404 0.77 KDR (0.97) FLT1FLT4KDRIMPDH2VCP
SCHEMBL7719438 0.74 IMPDH2 (0.76) IMPDH2VCP
SCHEMBL5480372 0.73 FLT1 (0.69) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5476166 0.72 FLT1 (0.66) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5477700 0.71 KDR (0.76) FLT1FLT4KDRIMPDH2VCP
SCHEMBL5316678 0.70 FLT1 (0.60) FLT1FLT4KDRIMPDH2VCP

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189712-B2 1,3-Oxazole compounds for the treatment of cancer SMITHKLINE BEECHAM CORPORATION (US) 2007-03-13 US disclosed