SCHEMBL16627697

SCHEMBL16627697

COc1ccc(CC(=O)n2c(=O)c(C(=O)NCCc3ccc(F)cc3)cc3ccccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.49
CNR1 P21554 1/20 0.49
KDM4E B2RXH2 1/20 0.47
KMT2A Q03164 5/20 0.47
FPR2 P25090 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 3/20 0.46
AHR P35869 1/20 0.46
POLB P06746 1/20 0.45
EGLN1 Q9GZT9 1/20 0.45

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
SCHEMBL16627698 0.89 CNR2 (0.47) CNR2CNR1AHR
SCHEMBL16627881 0.80 SMN1; SMN2 (0.50) CNR2CNR1KDM4EKMT2AMEN1
SCHEMBL16627837 0.80 NR1H2 (0.41) CNR2CNR1KDM4EKMT2ATP53
SCHEMBL16627836 0.79 NR1H2 (0.42) CNR2CNR1KDM4EKMT2ATP53
SCHEMBL16627841 0.78 NR1H2 (0.41) CNR2CNR1KDM4EKMT2ATP53
SCHEMBL16627770 0.77 KMT2A (0.57) KDM4EKMT2ATP53MAPTMEN1
SCHEMBL16627834 0.77 KMT2A (0.53) CNR2CNR1KDM4EKMT2AFPR2
SCHEMBL5438302 0.75 KMT2A (0.55) KDM4EKMT2ATP53MAPTMEN1
SCHEMBL25474382 0.73 KMT2A (0.62) KDM4EKMT2AMAPTMEN1POLB
SCHEMBL16627581 0.73 CNR1 (0.54) CNR2CNR1KDM4EKMT2AMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015050379-A1 NOVEL QUINOLINONE DERIVATIVE AND USE THEREOF 광주과학기술원 2015-04-09 WO disclosed