SCHEMBL6580908

SCHEMBL6580908

C/C=C\Nc1cccc2c1c(O)c(OCC)c(=O)n2C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.38
TP53 P04637 2/20 0.36
ALDH1A1 P00352 7/20 0.36
KDM4E B2RXH2 6/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
POLB P06746 2/20 0.35
PABPC1 P11940 1/20 0.35
MAPT P10636 4/20 0.34
LMNA P02545 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
HPGD P15428 4/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
RECQL P46063 2/20 0.33
USP2 O75604 1/20 0.33
BRCA1 P38398 1/20 0.33
HTT P42858 1/20 0.33
YWHAG P61981 1/20 0.33
HBB P68871 1/20 0.33

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
SCHEMBL6580910 1.00 GAA (0.38) GAATP53ALDH1A1KDM4EMEN1
SCHEMBL6581984 0.82 ALDH1A1 (0.42) GAATP53ALDH1A1KDM4EMEN1
SCHEMBL6579041 0.78 ALDH1A1 (0.40) GAATP53ALDH1A1KDM4EMEN1
SCHEMBL7977916 0.72 HDAC6 (0.44) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL6580954 0.68 ALDH1A1 (0.38) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL8831028 0.67 KMT2A (0.43) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL6581127 0.66 KDM4E (0.43) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL6582186 0.66 ALDH1A1 (0.47) GAATP53ALDH1A1KDM4EMEN1
SCHEMBL6576831 0.64 ALDH1A1 (0.46) ALDH1A1KDM4ELMNAHPGD
SCHEMBL6581691 0.63 MEN1 (0.39) TP53ALDH1A1KDM4EMEN1KMT2A

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