SCHEMBL27948877

SCHEMBL27948877

CCC(=O)c1c(O)c2ccccc2[nH]c1=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.68
RAB9A P51151 2/20 0.67
POLB P06746 1/20 0.61
KMT2A Q03164 5/20 0.59
MEN1 O00255 4/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NLRP3 Q96P20 1/20 0.59
USP2 O75604 1/20 0.59
RXFP1 Q9HBX9 1/20 0.58
ALDH1A1 P00352 6/20 0.57
HPGD P15428 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
MAPT P10636 3/20 0.57
IDE P14735 1/20 0.57
MPI P34949 1/20 0.57
CACNA1B Q00975 1/20 0.57
APBA1 Q02410 1/20 0.57
GAA P10253 1/20 0.57
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56

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
SCHEMBL2284247 0.82 KDM4E (0.69) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL1058188 0.81 KDM5A (0.68) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL12857657 0.80 KDM4E (1.00) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL3985154 0.80 KDM4E (0.74) KDM4ERAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6519951 0.80 GSK3B (0.58) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL1228041 0.79 KDM4E (0.62) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL30681958 0.78 KDM4E (0.71) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL1622313 0.78 KDM4E (0.71) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL7827583 0.78 KDM5A (0.66) KDM4ERAB9APOLBKMT2AMEN1
SCHEMBL15200787 0.78 KMT2A (0.72) KDM4ERAB9APOLBKMT2AMEN1

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
CN-103508950-B Containing 4-hydroxyl-2-quinolinones compound and the Synthesis and applications thereof of imine structure NANKAI UNIVERSITY (CN) 2016-04-20 CN disclosed
CN-103508950-A 4-hydroxy-2-quinolinone compounds containing imine structure, and preparation and application thereof UNIV NANKAI 2014-01-15 CN disclosed