SCHEMBL10186154

SCHEMBL10186154

COC(=O)c1cc2[nH]c(=O)c(=O)[nH]c2cc1CO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 2/20 0.59
GRIA2 P42262 2/20 0.59
GRIA3 P42263 2/20 0.59
GRIA4 P48058 2/20 0.59
GRIN2D O15399 5/20 0.47
GRIN3B O60391 5/20 0.47
GRIN1 Q05586 5/20 0.47
GRIN2A Q12879 5/20 0.47
GRIN2B Q13224 5/20 0.47
GRIN2C Q14957 5/20 0.47
GRIN3A Q8TCU5 5/20 0.47
KDM4E B2RXH2 3/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.41
PARP1 P09874 2/20 0.41
ALDH1A1 P00352 2/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL471040 0.89 GRIN2D (0.58) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL471034 0.86 GRIN2D (0.46) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL1721600 0.78 GRIN2D (0.55) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7908962 0.77 GRIN2D (0.54) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7899516 0.77 GRIN2D (0.63) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL9662171 0.73 GAA (0.47) KDM4EGAAALDH1A1PDE3BPDE3A
SCHEMBL29115437 0.70 GRIA1 (0.69) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL9316198 0.69 MAPT (0.41) KDM4EGLAGAAMAPTALDH1A1
SCHEMBL23021147 0.68 MAPT (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5368743 0.68 PARP1 (0.63) KDM4EGLAGAAMAPTPARP1

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
EP-2404922-A1 QUINOXALINE COMPOUNDS Astellas Pharma Inc. (JP) 2012-01-11 EP disclosed