SCHEMBL3239605

SCHEMBL3239605

O=C(O)Oc1cn(CCO)c2cc(F)c(Cc3cccc(Cl)c3Cl)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.41
SLC22A12 Q96S37 2/20 0.36
MAPT P10636 6/20 0.34
RXFP1 Q9HBX9 2/20 0.34
GAA P10253 1/20 0.33
TP53 P04637 4/20 0.33
ALDH1A1 P00352 1/20 0.32
P2RX7 Q99572 1/20 0.32
CMA1 P23946 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL3246498 0.92 METTL3 (0.40) METTL3SLC22A12MAPTRXFP1GAA
SCHEMBL3235851 0.92 METTL3 (0.39) METTL3SLC22A12MAPTRXFP1GAA
SCHEMBL3242292 0.90 METTL3 (0.39) METTL3SLC22A12MAPTRXFP1GAA
SCHEMBL3241875 0.89 METTL3 (0.42) METTL3SLC22A12MAPTRXFP1GAA
SCHEMBL3247219 0.89 SLC22A12 (0.43) METTL3SLC22A12MAPTTP53CMA1
SCHEMBL3239987 0.88 METTL3 (0.49) METTL3SLC22A12MAPTGAATP53
SCHEMBL1045220 0.88 METTL3 (0.46) METTL3MAPTRXFP1GAAALDH1A1
SCHEMBL3245315 0.86 METTL3 (0.36) METTL3SLC22A12MAPTGAATP53
SCHEMBL3232535 0.86 METTL3 (0.41) METTL3SLC22A12MAPTRXFP1GAA
SCHEMBL3239637 0.85 SLC22A12 (0.39) METTL3SLC22A12MAPTGAATP53

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