SCHEMBL3243386

SCHEMBL3243386

COc1cc(Cc2cccc(Cl)c2F)cc2c(=O)c(OC(=O)O)cn([C@H](CO)C3CCCCC3)c12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.46
PYGL P06737 2/20 0.34
F11 P03951 3/20 0.33
CFD P00746 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
EGFR P00533 3/20 0.32
APLNR P35414 1/20 0.32
PLA2G4A P47712 1/20 0.32
CNR2 P34972 1/20 0.32
CCR2 P41597 1/20 0.32

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
SCHEMBL3242029 0.94 METTL3 (0.43) METTL3PYGLCFDRXFP1
SCHEMBL3245374 0.94 METTL3 (0.41) METTL3PYGLCFDRXFP1EGFR
SCHEMBL1041873 0.92 METTL3 (0.56) METTL3PYGLF11CFDPLA2G4A
SCHEMBL1041874 0.92 METTL3 (0.56) METTL3PYGLF11CFDPLA2G4A
SCHEMBL3243314 0.88 METTL3 (0.53) METTL3CFDHTR1DHTR1BEGFR
SCHEMBL3242587 0.87 METTL3 (0.46) METTL3PYGLCFDEGFRCNR2
SCHEMBL1044555 0.86 METTL3 (0.52) METTL3PYGLCFD
SCHEMBL1044553 0.86 METTL3 (0.52) METTL3PYGLCFD
SCHEMBL3243260 0.86 METTL3 (0.61) METTL3PYGLCFDHTR1DHTR1B
SCHEMBL3240029 0.85 METTL3 (0.49) METTL3CFDHTR1DHTR1BEGFR

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