SCHEMBL6273530

SCHEMBL6273530

C=C(C)C(=O)N[C@@H](CCCCN)C(=O)OC=C(C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.39
FOLH1 Q04609 1/20 0.35
SIRT6 Q8N6T7 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
SLC6A5 Q9Y345 1/20 0.34
GSR P00390 1/20 0.33
CPB2 Q96IY4 3/20 0.32
CPB1 P15086 1/20 0.32
ERAP2 Q6P179 3/20 0.31
LNPEP Q9UIQ6 1/20 0.31
ITGB3 P05106 4/20 0.31
ITGA2B P08514 4/20 0.31
ERAP1 Q9NZ08 1/20 0.31
TLR2 O60603 1/20 0.31
ANPEP P15144 1/20 0.30

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
SCHEMBL31243301 0.81 TGFBR1 (0.44) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL29267410 0.81 TGFBR1 (0.44) TGFBR1FOLH1SIRT6SIRT1CPB2
SCHEMBL6579582 0.78 TGFBR1 (0.59) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL686694 0.78 TGFBR1 (0.59) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL1690444 0.78 TGFBR1 (0.59) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL8376832 0.75 TGFBR1 (0.46) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL31571912 0.73 TGFBR1 (0.61) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL28796151 0.73 SIRT6 (0.49) FOLH1SIRT6SIRT1SLC6A5CPB2
SCHEMBL31571914 0.72 TGFBR1 (0.59) TGFBR1FOLH1SIRT6SIRT1SLC6A5
SCHEMBL11921509 0.70 SIRT6 (0.44) TGFBR1FOLH1SIRT6SIRT1ERAP2

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-2005099651-A1 HYBRID COATED COSMETIC POWDERS AND METHODS OF MAKING AND USING SAME KOBO PRODUCTS, INC. (US) 2005-10-27 WO disclosed