SCHEMBL6579489

SCHEMBL6579489

COCC(=O)N(C)c1cc(N)ccc1C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.51
KDM4E B2RXH2 7/20 0.41
ALDH1A1 P00352 6/20 0.41
HSD17B10 Q99714 4/20 0.41
MAPT P10636 4/20 0.41
HPGD P15428 2/20 0.41
GLA P06280 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41
ABL1 P00519 1/20 0.40
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 3/20 0.38
CFTR P13569 2/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
PDK2 Q15119 1/20 0.36

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
SCHEMBL6579987 0.89 GAA (0.49) GAAKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6577096 0.84 GAA (0.44) GAAKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6576838 0.84 GAA (0.49) GAAKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6578827 0.83 GAA (0.43) GAAKDM4EALDH1A1HSD17B10HPGD
SCHEMBL6578901 0.82 GAA (0.42) GAAKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6577038 0.82 GAA (0.47) GAAKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6579806 0.81 ALDH1A1 (0.38) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL8308701 0.81 GAA (0.46) GAAKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6581729 0.80 TDP1 (0.55) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL6577277 0.80 GAA (0.45) GAAKDM4EALDH1A1HSD17B10MAPT

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
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed