SCHEMBL8617675

SCHEMBL8617675

CCOP(=O)(Cn1c(=O)c(=O)[nH]c2c3ccccc3c(N)cc21)OCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.35
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIA1 P42261 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA3 P42263 1/20 0.34
GRIA4 P48058 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
PLK1 P53350 1/20 0.31

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
SCHEMBL8619772 0.84 ALDH1A1 (0.32) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8616658 0.83 SIRT2 (0.40) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8616771 0.82 GRIA1 (0.48) PARP1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL8618027 0.82 PARP1 (0.36) PARP1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL8622802 0.82 KDM4E (0.38) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8618755 0.81 ALDH1A1 (0.36) CYP1A2KDM4EALDH1A1GAAHPGD
SCHEMBL8618696 0.80 PLK1 (0.31) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8624742 0.74 GRIK1 (0.38) PARP1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL8107468 0.72 GRIA1 (0.43) PARP1GRIN2DGRIN3BGRIA1GRIA2
SCHEMBL8621635 0.72 KDM4D (0.35) PARP1GRIN2DGRIN3BGRIA1GRIA2

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 4 patents. 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
EP-0696289-B1 BENZO[F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS SCHERING AG (DE) 1997-03-12 EP disclosed
EP-0696289-A1 BENZO F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS SCHERING AG (DE) 1996-02-14 EP disclosed
WO-1994025470-A1 BENZO[F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS SCHERING AKTIENGESELLSCHAFT (DE) 1994-11-10 WO disclosed