SCHEMBL6579509

SCHEMBL6579509

C=CCNc1ccc(C(=O)OCC)c(N(C)C(=O)COCc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
SENP1 Q9P0U3 1/20 0.42
MCL1 Q07820 1/20 0.39
CSNK1D P48730 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 3/20 0.37
TGM2 P21980 2/20 0.37
F13A1 P00488 1/20 0.37
TGM1 P22735 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HTT P42858 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL6581444 0.93 EGFR (0.39) ALDH1A1LMNAKDM4EHPGDL3MBTL1
SCHEMBL8307546 0.83 PPARA (0.33) ALDH1A1LMNATDP1KMT2ATGM2
SCHEMBL6582847 0.80 KMT2A (0.43) ALDH1A1LMNAKDM4EHPGDCSNK1D
SCHEMBL6577225 0.79 SENP1 (0.48) ALDH1A1LMNAKDM4EHPGDL3MBTL1
SCHEMBL6578789 0.79 SMN1; SMN2 (0.47) ALDH1A1L3MBTL1KMT2AMEN1RAB9A
SCHEMBL6579793 0.78 CA1 (0.39) ALDH1A1LMNAKDM4EHPGDSENP1
SCHEMBL6578934 0.78 RAB9A (0.43) ALDH1A1LMNAKDM4EHPGDL3MBTL1
SCHEMBL6579076 0.77 HDAC8 (0.41) ALDH1A1L3MBTL1TDP1SENP1TSHR
SCHEMBL6579875 0.77 KMT2A (0.41) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL8302041 0.76 HDAC11 (0.35) ALDH1A1LMNAKDM4EHPGDL3MBTL1

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