SCHEMBL3245377

SCHEMBL3245377

CC(C)c1cc2c(cc1Cc1cccc(Cl)c1F)c(=O)c(OC(=O)O)cn2[C@@H](C)CO

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.59
PLA2G4A P47712 3/20 0.34
CFD P00746 5/20 0.32
MAPT P10636 1/20 0.32
GAA P10253 1/20 0.31
EGFR P00533 1/20 0.31
TP53 P04637 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL3245215 0.91 METTL3 (0.71) METTL3PLA2G4AMAPTGAAEGFR
SCHEMBL3243387 0.90 METTL3 (0.61) METTL3PLA2G4ACFDMAPTGAA
SCHEMBL1045205 0.89 METTL3 (0.68) METTL3PLA2G4ACFDMAPTGAA
SCHEMBL1045204 0.89 METTL3 (0.68) METTL3PLA2G4ACFDMAPTGAA
SCHEMBL3240262 0.86 METTL3 (0.54) METTL3PLA2G4ACFDMAPTGAA
SCHEMBL3241799 0.86 METTL3 (0.54) METTL3PLA2G4ACFDMAPTGAA
SCHEMBL3241842 0.83 METTL3 (0.83) METTL3PLA2G4AMAPTGAAEGFR
SCHEMBL3243274 0.82 METTL3 (0.71) METTL3CFDMAPTEGFRTP53
SCHEMBL3234873 0.82 METTL3 (0.66) METTL3PLA2G4AMAPTGAAEGFR
SCHEMBL3242581 0.81 METTL3 (0.72) METTL3PLA2G4AMAPTGAAEGFR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1564210-B9 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2010-03-31 EP claimed
EP-1564210-B1 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2009-09-16 EP claimed