SCHEMBL8090598

SCHEMBL8090598

O=c1[nH]c2cc(C(F)(F)F)c(OC(F)(F)C(F)(F)CF)cc2n(CP(=O)(O)O)c1=O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 14/20 0.51
GRIA2 P42262 14/20 0.51
GRIA3 P42263 14/20 0.51
GRIA4 P48058 14/20 0.51
GRIN2D O15399 1/20 0.51
GRIN3B O60391 1/20 0.51
GRIN1 Q05586 1/20 0.51
GRIN2A Q12879 1/20 0.51
GRIN2B Q13224 1/20 0.51
GRIN2C Q14957 1/20 0.51
GRIN3A Q8TCU5 1/20 0.51
GRIK1 P39086 8/20 0.41
GRIK2 Q13002 8/20 0.41
GRIK3 Q13003 8/20 0.41
GRIK5 Q16478 8/20 0.41
GRIK4 Q16099 7/20 0.41

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
SCHEMBL8083806 0.94 GRIA1 (0.49) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8098793 0.81 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8083730 0.80 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8095672 0.80 GRIA1 (0.51) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8091804 0.78 GRIA1 (0.49) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8083798 0.78 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8090247 0.77 GRIA1 (0.47) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8090724 0.77 GRIA1 (0.47) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8083572 0.77 GRIA1 (0.50) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8095918 0.76 GRIA1 (0.47) 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
US-6136805-A Quinoxaline dione derivatives, their production and their use in medicaments SCNERING AKTIENGESELLSCHAFT (DE) 2000-10-24 US disclosed