SCHEMBL5722678

SCHEMBL5722678

N#CN=c1[nH]c2cc(F)c([N+](=O)[O-])cc2[nH]c1=O.[Na].[Na]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIA2 P42262 6/20 0.49
▸ GRIA1 P42261 5/20 0.49
▸ GRIA3 P42263 5/20 0.49
▸ GRIA4 P48058 5/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ 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
▸ GRIK1 P39086 3/20 0.47
▸ GRIK2 Q13002 3/20 0.47
▸ GRIK3 Q13003 3/20 0.47
▸ GRIK4 Q16099 3/20 0.47
▸ GRIK5 Q16478 3/20 0.47
▸ LMNA P02545 1/20 0.47

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
SCHEMBL5722914 0.99 GRIA2 (0.50) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722909 0.99 GRIA2 (0.50) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722691 0.99 GRIA2 (0.50) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722688 0.99 GRIA2 (0.50) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722674 0.97 GRIA2 (0.49) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722676 0.97 GRIA2 (0.49) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722774 0.80 GRIA1 (0.55) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL4704610 0.80 GRIA2 (0.74) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722553 0.78 GRIA1 (0.56) GRIA2GRIA1GRIA3GRIA4CYP1A2
SCHEMBL5722549 0.78 GRIA1 (0.56) GRIA2GRIA1GRIA3GRIA4CYP1A2

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-1097927-B1 CYANOIMINOQUINOXALINE DERIVATIVES SHIONOGI & CO (JP) 2006-07-19 — — EP disclosed
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