SCHEMBL6131385

SCHEMBL6131385

COc1ccc(C(OC(COCCOCCOCCOCCOCCO)C(N)CCN)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 12/20 0.40
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 1/20 0.36
SLC6A1 P30531 2/20 0.33
SLC6A11 P48066 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31

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
SCHEMBL6046721 0.84 KIF11 (0.39) KIF11KCNH2ALDH1A1SLC6A1SLC6A11
SCHEMBL6046722 0.81 KIF11 (0.41) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL6046726 0.77 KIF11 (0.46) KIF11KCNH2SLC6A1SLC6A11SMN1; SMN2
SCHEMBL6131386 0.76 KIF11 (0.43) KIF11KCNH2SLC6A1SLC6A11SMN1; SMN2
SCHEMBL2400336 0.74 SLC6A11 (0.46) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL2385290 0.74 SLC6A11 (0.46) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL6040158 0.74 SLC6A11 (0.46) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL13575115 0.74 SLC6A11 (0.46) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL4300671 0.73 KIF11 (0.42) KIF11KCNH2SMN1; SMN2NR1H2NR1H3
SCHEMBL6570209 0.71 CASR (0.44) KIF11KCNH2SLC6A1SLC6A11

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-6962784-B2 Vascular endothelial growth factor (VEGF) nucleic acid ligand complexes GILEAD SCIENCES, INC. (US) 2005-11-08 US disclosed