SCHEMBL901401

SCHEMBL901401

CC(=O)ONC(CCCCCCN)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.47
SLC6A5 Q9Y345 1/20 0.47
CPB2 Q96IY4 7/20 0.44
GSR P00390 1/20 0.43
RNPEP Q9H4A4 1/20 0.42
SIRT6 Q8N6T7 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
PAOX Q6QHF9 3/20 0.38
TLR2 O60603 1/20 0.38

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
SCHEMBL28437067 0.84 FOLH1 (0.45) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL3789730 0.83 FOLH1 (0.44) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL30257380 0.82 FOLH1 (0.53) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL29193624 0.81 FOLH1 (0.51) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL2038707 0.81 FOLH1 (0.51) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL30935981 0.80 FOLH1 (0.54) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL29893687 0.79 FOLH1 (0.53) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL29741283 0.79 FOLH1 (0.53) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL31642200 0.77 FOLH1 (0.54) FOLH1SLC6A5CPB2GSRRNPEP
SCHEMBL30360538 0.77 FOLH1 (0.54) FOLH1SLC6A5CPB2GSRRNPEP

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
WO-2012044832-A1 METHODS OF TREATING A SUBJECT AND RELATED PARTICLES, POLYMERS AND COMPOSITIONS FETZER OLIVER S (US) 2012-04-05 WO disclosed