SCHEMBL8165348

SCHEMBL8165348

O=C(c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1F)N1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 16/20 0.60
CYP2C9 P11712 8/20 0.60
CYP2D6 P10635 4/20 0.60
CYP1A2 P05177 6/20 0.53
GAA P10253 1/20 0.52
CYP2C19 P33261 3/20 0.52
CYP3A4 P08684 1/20 0.52

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
SCHEMBL8163366 0.92 GRIA2 (0.71) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1424279 0.85 GRIA2 (0.71) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1423823 0.85 GRIA2 (0.74) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1424041 0.85 GRIA2 (0.62) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL3136897 0.85 GRIA2 (0.83) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL8170149 0.82 GRIA2 (0.71) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1424092 0.80 GRIA2 (0.55) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1424200 0.79 GRIA2 (0.54) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1423917 0.78 GRIA2 (0.58) GRIA2CYP2C9CYP2D6CYP1A2GAA
SCHEMBL1423753 0.78 GRIA2 (0.51) GRIA2CYP2C9CYP2D6CYP1A2GAA

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
WO-2008110566-A1 COMPOUNDS WHICH POTENTIATE AMPA RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-09-18 WO disclosed