SCHEMBL7988591

SCHEMBL7988591

CCCCCCOc1c(O)c(=O)n(CC)c2cc(N)ccc12

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 8/20 0.43
KDM4E B2RXH2 3/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
GFER P55789 1/20 0.40
SRC P12931 1/20 0.40
TSHR P16473 1/20 0.39
LMNA P02545 4/20 0.39
TDP1 Q9NUW8 3/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
MAPK1 P28482 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
SCHEMBL8004318 0.95 KDM4E (0.42) GSK3BKDM4EMAPTALDH1A1GAA
SCHEMBL8001742 0.92 KDM4E (0.44) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL8004312 0.92 KDM4E (0.44) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL8001159 0.92 TYMS (0.41) KDM4EMAPTALDH1A1TSHRLMNA
SCHEMBL7992059 0.92 KDM4E (0.40) KDM4EMAPTALDH1A1GAATSHR
SCHEMBL8000864 0.91 GSK3B (0.45) GSK3BKDM4EMAPTALDH1A1GAA
SCHEMBL8000640 0.91 GSK3B (0.45) GSK3BKDM4EMAPTALDH1A1GAA
SCHEMBL8001658 0.90 KDM4E (0.44) KDM4EMAPTALDH1A1LMNAMEN1
SCHEMBL8004113 0.90 KDM4E (0.44) KDM4EMAPTALDH1A1LMNAMEN1
SCHEMBL8000570 0.89 ALDH1A1 (0.43) GSK3BKDM4EMAPTALDH1A1GAA

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