SCHEMBL3241571

SCHEMBL3241571

C[C@@H](CO)n1cc(OC(=O)O)c(=O)c2cc(Cc3cccc(Cl)c3F)cc(N(C)C)c21

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.47
CXCR2 P25025 2/20 0.33
EGFR P00533 5/20 0.32
PLA2G4A P47712 1/20 0.31
P2RX7 Q99572 2/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL1045313 0.89 METTL3 (0.55) METTL3CXCR2P2RX7
SCHEMBL1045314 0.89 METTL3 (0.55) METTL3CXCR2P2RX7
SCHEMBL3243314 0.89 METTL3 (0.53) METTL3EGFRPLA2G4ALMNA
SCHEMBL3239885 0.88 METTL3 (0.48) METTL3PLA2G4AP2RX7LMNA
SCHEMBL3239627 0.87 METTL3 (0.47) METTL3EGFRPLA2G4A
SCHEMBL3241137 0.85 METTL3 (0.40) METTL3P2RX7
SCHEMBL3240262 0.84 METTL3 (0.54) METTL3PLA2G4AP2RX7LMNA
SCHEMBL3241799 0.84 METTL3 (0.54) METTL3PLA2G4AP2RX7LMNA
SCHEMBL3243346 0.82 METTL3 (0.60) METTL3EGFRPLA2G4ALMNA
SCHEMBL3235872 0.82 METTL3 (0.50) METTL3EGFRPLA2G4ALMNA

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