SCHEMBL9978422

SCHEMBL9978422

CC(C)C(CC=CCl)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
ECE1 P42892 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
SCHEMBL9978423 1.00 GRIK1 (0.39) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL9978421 1.00 GRIK1 (0.39) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL10308328 0.87 SLC1A3 (0.37) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL13710824 0.87 SLC1A3 (0.37) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL2232483 0.81 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL2232479 0.81 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL622161 0.81 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL5002016 0.81 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL5264842 0.81 GRIK1 (0.44) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL10119429 0.81 GRIK1 (0.36) GRIK1GRIK2

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-2011148392-A1 PROCESS FOR THE PREPARATION OF (2S,4S,5S,7S)-N-(2-CARBAMYL-2- METHYLPROPYL)-5-AMINO-4-HYDROXY-2,7-DIISOPROPYL-8-[4-METHOXY-3-(3- METHOXYPROPOXY)PHENYL]-OCTANAMIDE HEMIFUMARATE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES LIMITED (IN) 2011-12-01 WO disclosed