SCHEMBL6581691

SCHEMBL6581691

CCCCCCCCCCNc1cccc2c(O)c(OCC)c(=O)n(C)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 3/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 2/20 0.39
POLB P06746 2/20 0.39
RGS12 O14924 1/20 0.39
USP2 O75604 1/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TLR9 Q9NR96 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.38
DYRK3 O43781 1/20 0.37
RPS6KB1 P23443 1/20 0.37
EPHA2 P29317 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
SCHEMBL6579154 0.83 KDM4E (0.42) MEN1KMT2AMAPTMAPK1HTT
SCHEMBL6579792 0.78 ALOX15 (0.39) MEN1KMT2AMAPTMAPK1HTT
SCHEMBL6579802 0.78 ALOX15 (0.39) MEN1KMT2AMAPTMAPK1HTT
SCHEMBL7964612 0.77 ALDH1A1 (0.44) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL7974970 0.76 KDM4E (0.43) MAPTMAPK1HTTPOLBNPSR1
SCHEMBL7975932 0.75 ALOX5 (0.42) MAPTHTTALDH1A1KDM4EHPGD
SCHEMBL7978004 0.74 KDM4E (0.44) ALDH1A1KDM4EHPGDHSD17B10CNR1
SCHEMBL6576756 0.72 ESR1 (0.42) MAPTHTTL3MBTL1ALDH1A1KDM4E
SCHEMBL27387414 0.72 ALDH1A1 (0.63) KMT2AMAPTHTTALDH1A1KDM4E
SCHEMBL8004439 0.72 KDM4E (0.42) MAPTALDH1A1KDM4EHPGDHSD17B10

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 3 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
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