SCHEMBL8296644

SCHEMBL8296644

NC(Cn1cc(F)c(=O)[nH]c1=O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 10/20 1.00
GRIA2 P42262 9/20 1.00
GRIA4 P48058 9/20 1.00
GRIK5 Q16478 9/20 1.00
CYP1A2 P05177 2/20 1.00
KDM4E B2RXH2 1/20 1.00
GRIA3 P42263 1/20 1.00
KMT2A Q03164 2/20 0.69
BLM P54132 1/20 0.69
HSD17B10 Q99714 1/20 0.69
LMNA P02545 2/20 0.48
GRIK1 P39086 1/20 0.45

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
SCHEMBL5000789 1.00 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL12648446 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL8631021 0.82 GRIA1 (0.69) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL13957600 0.82 GRIA1 (0.69) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL4311549 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL401659 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL14478236 0.80 GRIA1 (0.66) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL25312715 0.79 GRIA1 (0.66) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL29499324 0.79 GRIA1 (0.64) GRIA1GRIA2GRIA4GRIK5CYP1A2
SCHEMBL12113221 0.77 GRIA1 (0.62) GRIA1GRIA2GRIA4GRIK5CYP1A2

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-2005007106-A2 COMPOSITIONS OF A CYCLOOXYGENASE-2 SELECTIVE INHIBITOR AND A NON-NMDA GLUTAMATE MODULATOR FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DAMAGE PHARMACIA CORPORATION (US) 2005-01-27 WO disclosed