SCHEMBL8342149

SCHEMBL8342149

CCOP(=O)(OCC)C(C)n1c(=O)c(=O)[nH]c2cc([N+](=O)[O-])c(F)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 3/20 0.38
GRIK2 Q13002 3/20 0.38
GRIK3 Q13003 3/20 0.38
GRIK4 Q16099 3/20 0.38
GRIK5 Q16478 3/20 0.38
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36
GRIA1 P42261 3/20 0.35
GRIA2 P42262 3/20 0.35
GRIA3 P42263 3/20 0.35
GRIA4 P48058 3/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 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
SCHEMBL8345257 0.96 GRIN2D (0.38) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8344977 0.85 CA12 (0.41) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8340567 0.84 GRIN1 (0.39) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8340369 0.83 MAPT (0.41) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8342152 0.82 GRIK1 (0.36) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8343002 0.81 MAPT (0.41) LMNACYP1A2CYP3A4MAPTHPGD
SCHEMBL8346035 0.81 SLC22A6 (0.56) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8340503 0.80 GRIN1 (0.37) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8121197 0.79 GRIK1 (0.45) GRIK1GRIK2GRIK3GRIK4GRIK5
SCHEMBL8345478 0.79 GRIK1 (0.54) GRIK1GRIK2GRIK3GRIK4GRIK5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5955461-A Quinoxalinedione derivatives, their production and use in pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1999-09-21 US disclosed
US-5750525-A Quinoxalinedione derivatives, their production and use in pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1998-05-12 US disclosed