SCHEMBL8937719

SCHEMBL8937719

COC[C@H](N)C(=O)C=C(C)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
GRIK1 P39086 5/20 0.32
GRIK2 Q13002 3/20 0.32
DDAH1 O94760 1/20 0.30
CYP2C9 P11712 1/20 0.30
GFPT1 Q06210 1/20 0.30
GRIA2 P42262 2/20 0.30
GRIA4 P48058 2/20 0.30
GRIK3 Q13003 2/20 0.30
GRIK5 Q16478 2/20 0.30
GRIA1 P42261 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
SCHEMBL21924962 0.79 GRIK1 (0.35) GRIK1GRIK2CYP2C9GRIA2GRIA4
SCHEMBL8013132 0.73 NOS3 (0.35) NOS3NOS1NOS2GRIK1GRIK2
SCHEMBL18173605 0.71 GABRP (0.34) GRIK1GRIK2CYP2C9GRIA2GRIA4
SCHEMBL17391662 0.71 GABRP (0.34) GRIK1GRIK2CYP2C9GRIA2GRIA4
SCHEMBL18173601 0.71 GABRP (0.34) GRIK1GRIK2CYP2C9GRIA2GRIA4
SCHEMBL15826904 0.71
SCHEMBL12965970 0.71
SCHEMBL127189 0.71
SCHEMBL14870685 0.71
Hydrochloric Acid SCHEMBL856592 0.71

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-5499128-A Liquid crystal display device with acrylic polymer spacers and method of manufacturing the same KABUSHIKI KAISHA TOSHIBA (JP) 1996-03-12 US disclosed