SCHEMBL8000599

SCHEMBL8000599

CCCCOc1c(OC(C)=O)c(=O)[nH]c2cc(NC)ccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.38
GLA P06280 2/20 0.38
GAA P10253 2/20 0.38
AR P10275 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CNR2 P34972 1/20 0.35
SERPINE1 P05121 2/20 0.35
ALDH1A1 P00352 4/20 0.34
GRIN2D O15399 2/20 0.34
GRIN3B O60391 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2C Q14957 2/20 0.34
GRIN3A Q8TCU5 2/20 0.34
HSD17B10 Q99714 1/20 0.34
GPR17 Q13304 1/20 0.34
MAOA P21397 1/20 0.34
TSHR P16473 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
SCHEMBL7997507 0.96 GPR17 (0.37) KDM4EGLAGAAARSERPINE1
SCHEMBL8004437 0.86 AR (0.40) KDM4EGLAGAAARCNR2
SCHEMBL8066755 0.84 PARP1 (0.42) KDM4EGLAGAAMEN1KMT2A
SCHEMBL8004359 0.84 AR (0.40) KDM4EGAAARCNR2SERPINE1
SCHEMBL8004193 0.83 GRIN2D (0.46) KDM4EGLAGAAARMEN1
SCHEMBL7997467 0.83 ALDH1A1 (0.36) KDM4EGLAGAAARMEN1
SCHEMBL8001316 0.83 AR (0.38) KDM4EARMEN1KMT2ACNR2
SCHEMBL7999685 0.83 AR (0.38) KDM4EARMEN1KMT2ACNR2
SCHEMBL7999975 0.82 UNG (0.39) KDM4EGLAGAAARCNR2
SCHEMBL7997470 0.81 AR (0.36) KDM4EGLAGAAARGRIN2D

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