SCHEMBL2037840

SCHEMBL2037840

O=c1[nH]c2cc(CC(F)(F)F)c(N3CCOCC3)cc2n(CP(=O)(O)O)c1=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 8/20 0.49
GRIA2 P42262 8/20 0.49
GRIA3 P42263 8/20 0.49
GRIA4 P48058 8/20 0.49
GRIN2D O15399 3/20 0.49
GRIN3B O60391 3/20 0.49
GRIN1 Q05586 3/20 0.49
GRIN2A Q12879 3/20 0.49
GRIN2B Q13224 3/20 0.49
GRIN2C Q14957 3/20 0.49
GRIN3A Q8TCU5 3/20 0.49
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
GRIK3 Q13003 2/20 0.36
GRIK4 Q16099 2/20 0.36
GRIK5 Q16478 2/20 0.36
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32

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
Fanapanel SCHEMBL29352240 0.86 GRIA1 (0.51) GRIA1GRIA2GRIA3GRIA4GRIN2D
Fanapanel SCHEMBL353357 0.86 GRIA1 (0.51) GRIA1GRIA2GRIA3GRIA4GRIN2D
Fanapanel SCHEMBL25432377 0.85 GRIA1 (0.50) GRIA1GRIA2GRIA3GRIA4GRIN2D
Fanapanel SCHEMBL30546194 0.85 GRIA1 (0.50) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL2037849 0.80 GRIA1 (0.49) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8107840 0.79 GRIA1 (0.50) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8344895 0.77 GRIA1 (0.50) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8122798 0.76 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8107335 0.76 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8340446 0.74 GRIA1 (0.50) GRIA1GRIA2GRIA3GRIA4GRIN2D

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-2338492-A1 Methods and compositions for the treatment of alzheimer Universidad del Pais Vasco (ES) 2011-06-29 EP disclosed