SCHEMBL3709873

SCHEMBL3709873

CC(CC(C)(C)S(N)(=O)=O)c1ccc(-c2ccc(C(C)CC(C)(C)S(N)(=O)=O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 17/20 0.46
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40

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
SCHEMBL7032122 0.88 GRIA4 (0.42) GRIA4GRIA1GRIA2GRIA3
SCHEMBL3828099 0.86 TAAR1 (0.47) GRIA4
SCHEMBL15663101 0.84 GRIA4 (0.62) GRIA4
SCHEMBL6940515 0.81 MAPT (0.51) GRIA4
SCHEMBL6936033 0.77 CA1 (0.48)
SCHEMBL6749856 0.76 CA1 (0.43)
SCHEMBL28938093 0.75 SLC22A12 (0.38)
SCHEMBL28938091 0.75 SLC22A12 (0.38)
SCHEMBL21295131 0.73 PNMT (0.47)
SCHEMBL30601282 0.70 CA1 (0.42)

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-2010087982-A1 GLUR2 RECEPTOR MODULATORS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-08-05 WO disclosed