SCHEMBL8289787

SCHEMBL8289787

CCOC(=O)c1c(-c2ccc(OCc3cc(F)cc(F)c3)cc2)c(C#N)c(CC)n1C

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 18/20 0.54
GRIA4 P48058 18/20 0.54
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38

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
SCHEMBL8289785 0.92 GRIA2 (0.60) GRIA2GRIA4
SCHEMBL8289872 0.90 GRIA4 (0.69) GRIA2GRIA4
SCHEMBL8289333 0.88 GRIA2 (0.57) GRIA2GRIA4KDM4EMEN1ALDH1A1
SCHEMBL4373295 0.88 GRIA2 (0.59) GRIA2GRIA4
SCHEMBL8288315 0.87 GRIA2 (0.64) GRIA2GRIA4
SCHEMBL13863270 0.84 GRIA2 (0.66) GRIA2GRIA4KDM4EMEN1ALDH1A1
SCHEMBL4482679 0.84 GRIA2 (0.56) GRIA2GRIA4
SCHEMBL8288317 0.84 GRIA2 (0.75) GRIA2GRIA4
SCHEMBL8289784 0.83 GRIA2 (0.60) GRIA2GRIA4KDM4EMEN1ALDH1A1
SCHEMBL4373418 0.82 GRIA2 (0.56) GRIA2GRIA4

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-2005040110-A1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2005-05-06 WO disclosed