SCHEMBL7998872

SCHEMBL7998872

CCOc1c(OC(C)=O)c(=O)n(CC)c2cc(N)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.42
ALDH1A1 P00352 9/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 5/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
TNF P01375 2/20 0.36
METAP2 P50579 1/20 0.36
SRC P12931 2/20 0.36
ELANE P08246 1/20 0.35
FDPS P14324 1/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 3/20 0.35
MAPK1 P28482 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
HTT P42858 1/20 0.35
HBB P68871 1/20 0.35
CASP1 P29466 1/20 0.34

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
SCHEMBL7998635 0.90 KDM4E (0.40) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL8001889 0.89 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL7989157 0.89 KDM4E (0.41) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7998661 0.88 ALDH1A1 (0.38) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL8002264 0.88 GSK3B (0.39) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL7997247 0.87 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL8000680 0.87 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL8004333 0.87 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL8000900 0.85 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL7998663 0.84 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2MAPTGAA

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