SCHEMBL8616745

SCHEMBL8616745

NS(=O)(=O)c1cccc2c1ccc1[nH]c(=O)c(=O)n(CC(=O)O)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 7/20 0.40
GRIA2 P42262 7/20 0.40
GRIA3 P42263 7/20 0.40
GRIA4 P48058 7/20 0.40
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
CDK2 P24941 1/20 0.40
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ATIC P31939 1/20 0.38
KDM4E B2RXH2 2/20 0.36
USP2 O75604 1/20 0.36
GRIK1 P39086 3/20 0.35
GRIK2 Q13002 3/20 0.35

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
SCHEMBL8621405 0.83 GRIA1 (0.41) GRIA1GRIA2GRIA3GRIA4GRIN2D
Bicarbonate SCHEMBL8805354 0.81 CDK2 (0.41) GRIA1GRIA2GRIA3GRIA4CDK2
SCHEMBL3668211 0.79 GRIK1 (0.59) GRIA1GRIA2GRIA3GRIA4KMT2A
SCHEMBL8619799 0.78 CDK2 (0.38) GRIA1GRIA2GRIA3GRIA4CDK2
SCHEMBL7482033 0.77 FDPS (0.55) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8624851 0.77 KMT2A (0.33) GRIA1GRIA2GRIA3GRIA4CDK2
SCHEMBL8616696 0.73 CDK2 (0.37) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8622149 0.72 KMT2A (0.35) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8617926 0.72 CDK2 (0.35) GRIA1GRIA2GRIA3GRIA4CDK2
SCHEMBL9747625 0.69 KMT2A (0.56) GRIA1GRIA2GRIA3GRIA4GRIN2D

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-5710138-A Benzo f!quinoxalinedione derivatives, their production and use in pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed