SCHEMBL8001404

SCHEMBL8001404

COc1c(O)c(=O)[nH]c2cc(N(C)C)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.45
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 2/20 0.42
GLA P06280 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
USP2 O75604 1/20 0.38
PKM P14618 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
SCHEMBL7988442 0.83 KDM4E (0.51) ARKDM4EALDH1A1HSD17B10HPGD
SCHEMBL7997924 0.82 AR (0.40) ARKDM4EALDH1A1HSD17B10HPGD
SCHEMBL7998927 0.80 ALDH1A1 (0.38) ARKDM4EALDH1A1HSD17B10HPGD
SCHEMBL7998933 0.80 AR (0.38) ARKDM4EALDH1A1HSD17B10HPGD
SCHEMBL7988876 0.80 GPR84 (0.40) ARKDM4EALDH1A1HSD17B10HPGD
SCHEMBL8001287 0.79 PARP1 (0.53) ARKDM4EALDH1A1SMN1; SMN2GRIN2D
SCHEMBL3640753 0.78 KDM4E (0.51) ARKDM4EALDH1A1HSD17B10HPGD
SCHEMBL8001957 0.75 PARP1 (0.57) KDM4EALDH1A1GRIN2DGRIN3BGRIN1
SCHEMBL7997201 0.74 TDP1 (0.45) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL7997197 0.74 TDP1 (0.45) KDM4EALDH1A1HSD17B10HPGDGAA

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