SCHEMBL5519615

SCHEMBL5519615

C=C(CC(=O)CNC(=O)CN)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
GRM1 Q13255 1/20 0.32
GRM2 Q14416 1/20 0.32
TERT O14746 1/20 0.32
MMP2 P08253 1/20 0.31
AOC3 Q16853 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
SCHEMBL3328573 0.78 ALOX15 (0.44) ALOX15HSD17B10GRIK1GRIK2GRM1
SCHEMBL11197206 0.72 TERT (0.35) TERTMMP2AOC3
SCHEMBL19434714 0.71 GLRA1 (0.47) ALOX15HSD17B10TERTMMP2AOC3
SCHEMBL29952010 0.71
SCHEMBL14934 0.71
SCHEMBL12652396 0.70 TDP1 (0.41) TERTMMP2AOC3
SCHEMBL2516523 0.70
SCHEMBL16006906 0.69 GLRA1 (0.36) ALOX15HSD17B10TERTMMP2AOC3
Glycine SCHEMBL1234586 0.69 GLRA1 (0.53) ALOX15HSD17B10TERTMMP2AOC3
SCHEMBL9812291 0.69 GLRA1 (0.45) ALOX15HSD17B10TERTMMP2AOC3

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-20070111152-A1 Pre-cemented orthodontic appliances PRIMUS CAROLYN M 2007-05-17 US disclosed