SCHEMBL8340485

SCHEMBL8340485

CCOP(=O)(OCC)C(C)n1c(=O)c(=O)[nH]c2cc(C(F)(F)F)c(NC(C)=O)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 7/20 0.36
GRIA2 P42262 7/20 0.36
GRIA3 P42263 7/20 0.36
GRIA4 P48058 7/20 0.36
GRIK1 P39086 4/20 0.36
GRIK2 Q13002 4/20 0.36
GRIK3 Q13003 4/20 0.36
GRIK5 Q16478 4/20 0.36
GRIK4 Q16099 3/20 0.36
PARP1 P09874 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHEK1 O14757 1/20 0.33
DAPK3 O43293 1/20 0.33
PRKD3 O94806 1/20 0.33
MET P08581 1/20 0.33
PDGFRA P16234 1/20 0.33
FLT1 P17948 1/20 0.33
LTK P29376 1/20 0.33

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
SCHEMBL8342041 0.86 AR (0.38) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8346054 0.83 AR (0.36) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8344977 0.80 CA12 (0.41) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8345084 0.79 GRIA1 (0.37) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8345710 0.76 GRIA1 (0.31) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8124492 0.75 AR (0.40) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8346146 0.73 PGR (0.40)
SCHEMBL8343157 0.73 DAO (0.37) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8345257 0.71 GRIN2D (0.38) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8342149 0.71 GRIK1 (0.38) GRIA1GRIA2GRIA3GRIA4GRIK1

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