SCHEMBL6578736

SCHEMBL6578736

CCCCCCNc1ccc2c(O)c(OCc3ccccc3)c(=O)n(C)c2c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GSK3B P49841 8/20 0.41
HPGD P15428 3/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
XBP1 P17861 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38

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
SCHEMBL8004439 0.88 KDM4E (0.42) KDM4EGSK3BHPGDMAPTALDH1A1
SCHEMBL8001709 0.86 KDM4E (0.42) KDM4EGSK3BHPGDMAPTALDH1A1
SCHEMBL8001220 0.85 KDM4E (0.43) KDM4EHTTSMN1; SMN2GSK3BHPGD
SCHEMBL6582077 0.85 GSK3B (0.42) KDM4EGSK3BHPGDALDH1A1HSD17B10
SCHEMBL7988963 0.85 GSK3B (0.42) KDM4EGSK3BHPGDALDH1A1HSD17B10
SCHEMBL7998792 0.85 GSK3B (0.42) KDM4EGSK3BHPGDALDH1A1HSD17B10
SCHEMBL6579810 0.84 HPGD (0.45) KDM4ESMN1; SMN2HPGDLMNAHDAC6
SCHEMBL8001338 0.84 KDM4E (0.40) KDM4EGSK3BHPGDTP53ALDH1A1
SCHEMBL7997782 0.83 GSK3B (0.39) KDM4EGSK3BHPGDMAPTALDH1A1
SCHEMBL7997311 0.83 POLB (0.43) KDM4EHTTSMN1; SMN2HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed