SCHEMBL3243246

SCHEMBL3243246

O=C(O)Oc1cn(CC(O)c2ccccc2)c2ccc(Cc3cccc(Cl)c3Cl)cc2c1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
SLC22A12 Q96S37 2/20 0.36
TP53 P04637 5/20 0.36
MAPT P10636 5/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
METTL3 Q86U44 1/20 0.33
CNR2 P34972 1/20 0.33
PLA2G4A P47712 1/20 0.32
RXFP1 Q9HBX9 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
SCHEMBL3239173 0.90 SLC22A12 (0.39) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3245291 0.90 SLC22A12 (0.40) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3246682 0.89 SLC22A12 (0.38) LMNASLC22A12TP53MAPTPOLB
SCHEMBL1043630 0.88 GAA (0.45) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3239774 0.88 LMNA (0.46) LMNASLC22A12TP53MAPTALDH1A1
SCHEMBL3241599 0.86 SLC22A12 (0.40) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3246470 0.86 SLC22A12 (0.41) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3245381 0.86 ALDH1A1 (0.41) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3241672 0.85 PLA2G4A (0.38) LMNASLC22A12TP53MAPTPOLB
SCHEMBL3239637 0.85 SLC22A12 (0.39) LMNASLC22A12TP53MAPTPOLB

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