SCHEMBL6581079

SCHEMBL6581079

C=CNc1ccc(C(=O)OCC)c(N(C)C(=O)COC)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.45
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 5/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
MAPT P10636 3/20 0.37
NPC1 O15118 1/20 0.37
JAK3 P52333 1/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 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
SCHEMBL6581118 0.92 MAPT (0.37) KMT2ARAB9AKDM4EHSD17B10MEN1
SCHEMBL6577207 0.91 KMT2A (0.47) KMT2ARAB9AKDM4EHSD17B10MEN1
SCHEMBL6578998 0.80 KMT2A (0.51) KMT2ARAB9AKDM4EHSD17B10MEN1
SCHEMBL6577225 0.80 SENP1 (0.48) KMT2ARAB9AKDM4EHSD17B10MEN1
SCHEMBL6581270 0.79 KMT2A (0.42) KMT2ARAB9AKDM4EHSD17B10ALDH1A1
SCHEMBL6578819 0.76 TDP1 (0.41) KMT2AMEN1ALDH1A1MAPTJAK3
SCHEMBL6582042 0.76 KMT2A (0.38) KMT2ARAB9A
SCHEMBL6582048 0.76 KMT2A (0.38) KMT2ARAB9A
SCHEMBL6579199 0.76 CYP4F2 (0.39) KMT2AKDM4EHSD17B10MEN1ALDH1A1
SCHEMBL8302041 0.75 HDAC11 (0.35) KDM4EALDH1A1L3MBTL1HPGDLMNA

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