SCHEMBL3239586

SCHEMBL3239586

O=C(O)Oc1cn(CCO)c2ccc(Cc3cccc(F)c3Cl)cc2c1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
TP53 P04637 3/20 0.38
RXFP1 Q9HBX9 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.34
METTL3 Q86U44 1/20 0.34
THRB P10828 1/20 0.34
CNR2 P34972 1/20 0.34
CHRM1 P11229 1/20 0.33
HAT1 O14929 2/20 0.33
EP300 Q09472 2/20 0.33

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
SCHEMBL3245177 0.91 MAPT (0.40) MAPTTP53RXFP1SMN1; SMN2LMNA
SCHEMBL3239637 0.91 SLC22A12 (0.39) MAPTTP53LMNAALDH1A1METTL3
SCHEMBL3243374 0.90 LMNA (0.38) MAPTTP53RXFP1SMN1; SMN2LMNA
SCHEMBL3234940 0.89 METTL3 (0.44) MAPTTP53RXFP1SMN1; SMN2LMNA
SCHEMBL3245708 0.89 CNR2 (0.37) MAPTTP53RXFP1SMN1; SMN2LMNA
SCHEMBL3237634 0.88 TP53 (0.41) MAPTTP53LMNAALDH1A1METTL3
SCHEMBL1043686 0.88 CHRM1 (0.45) MAPTTP53RXFP1SMN1; SMN2LMNA
SCHEMBL3243769 0.87 SLC22A12 (0.40) MAPTTP53RXFP1SMN1; SMN2LMNA
SCHEMBL3241739 0.87 LMNA (0.35) MAPTTP53SMN1; SMN2LMNAALDH1A1
SCHEMBL3245011 0.87 LMNA (0.40) MAPTTP53SMN1; SMN2LMNAALDH1A1

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