SCHEMBL7988442

SCHEMBL7988442

CN(C)c1ccc2c(O)c(O)c(=O)[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 2/20 0.51
IDE P14735 1/20 0.51
MPI P34949 1/20 0.51
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
AR P10275 2/20 0.50
HPGD P15428 2/20 0.45
THRB P10828 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GRIN2D O15399 2/20 0.41
GRIN3B O60391 2/20 0.41
GRIN1 Q05586 2/20 0.41
GRIN2A Q12879 2/20 0.41
GRIN2B Q13224 2/20 0.41
GRIN2C Q14957 2/20 0.41
GRIN3A Q8TCU5 2/20 0.41
SRC P12931 1/20 0.41

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
SCHEMBL3640753 0.87 KDM4E (0.51) KDM4EALDH1A1MAPTARHPGD
SCHEMBL8001404 0.83 AR (0.45) KDM4EALDH1A1MAPTARHPGD
SCHEMBL7254503 0.77 ALDH1A1 (0.47) KDM4EALDH1A1MAPTARHPGD
SCHEMBL7999235 0.77 AR (0.40) KDM4EALDH1A1MAPTARHPGD
SCHEMBL7997924 0.77 AR (0.40) KDM4EALDH1A1MAPTARHPGD
SCHEMBL2268508 0.77 AR (0.61) KDM4EALDH1A1MAPTARHPGD
SCHEMBL7998933 0.75 AR (0.38) KDM4EALDH1A1MAPTARHPGD
SCHEMBL7988876 0.75 GPR84 (0.40) KDM4EALDH1A1ARHPGDTHRB
SCHEMBL7998927 0.75 ALDH1A1 (0.38) KDM4EALDH1A1MAPTARHPGD
SCHEMBL3641750 0.74 KDM4E (0.51) KDM4EALDH1A1MAPTARHPGD

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
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed