SCHEMBL16627783

SCHEMBL16627783

CCCC(=O)Nc1cccc2[nH]c(=O)c(C(=O)N(CC)c3ccccc3)cc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.47
ALDH1A1 P00352 7/20 0.47
KDM4E B2RXH2 6/20 0.47
HSD17B10 Q99714 2/20 0.47
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HPGD P15428 5/20 0.43
TP53 P04637 2/20 0.42
MAPK1 P28482 3/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.39

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
SCHEMBL16627787 0.93 PARP14 (0.47) PARP14ALDH1A1KDM4EKMT2AMEN1
SCHEMBL16627784 0.87 ALDH1A1 (0.46) PARP14ALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL16627896 0.82 PARP1 (0.40) PARP14ALDH1A1KDM4EKMT2AMEN1
SCHEMBL16627626 0.81 MAPT (0.47) PARP14ALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL15200885 0.80 TP53 (0.44) ALDH1A1KDM4EKMT2AMEN1HPGD
SCHEMBL16627777 0.77 SMN1; SMN2 (0.58) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL16627855 0.73 KDM4E (0.40) PARP14ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL16627688 0.72 MAPT (0.50) ALDH1A1KDM4EKMT2AHPGDRAB9A
SCHEMBL16627845 0.71 KDM4E (0.39) PARP14ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL16627596 0.70 KMT2A (0.52) ALDH1A1KDM4EHSD17B10KMT2AMEN1

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