SCHEMBL6579041

SCHEMBL6579041

CCOc1c(O)c2c(N)cccc2n(C)c1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
KDM4E B2RXH2 7/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
POLB P06746 2/20 0.39
PABPC1 P11940 1/20 0.39
TP53 P04637 1/20 0.38
GAA P10253 4/20 0.38
HPGD P15428 3/20 0.37
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CREB1 P16220 1/20 0.35
HTT P42858 1/20 0.35
DAO P14920 2/20 0.35
KDM1A O60341 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
SCHEMBL7976008 0.86 KDM4E (0.45) ALDH1A1KDM4EPOLBHPGDMAPT
SCHEMBL6581984 0.79 ALDH1A1 (0.42) ALDH1A1KDM4EKMT2AMEN1POLB
SCHEMBL6580908 0.78 GAA (0.38) ALDH1A1KDM4EKMT2AMEN1POLB
SCHEMBL6580910 0.78 GAA (0.38) ALDH1A1KDM4EKMT2AMEN1POLB
SCHEMBL7977894 0.74 VKORC1 (0.36) ALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7977898 0.74 VKORC1 (0.36) ALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL6581127 0.71 KDM4E (0.43) ALDH1A1KDM4EKMT2AMEN1GAA
SCHEMBL6582186 0.71 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2AMEN1POLB
SCHEMBL7999095 0.68 ALDH1A1 (0.42) ALDH1A1KDM4EPABPC1GAAHPGD
SCHEMBL7977916 0.68 HDAC6 (0.44) ALDH1A1KDM4EKMT2AMEN1POLB

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