SCHEMBL7048865

SCHEMBL7048865

COc1cc(C=CC(=O)OCc2ccccc2)cc(OC)c1O

nearest known ligand 0.83

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.83
ALOX5 P09917 9/20 0.77
CA12 O43570 2/20 0.77
CA4 P22748 2/20 0.77
CA6 P23280 2/20 0.77
CA5A P35218 2/20 0.77
CA7 P43166 2/20 0.77
CA9 Q16790 2/20 0.77
CA14 Q9ULX7 2/20 0.77
CA5B Q9Y2D0 2/20 0.77
LMNA P02545 1/20 0.65
AKR1B10 O60218 2/20 0.64
AKR1B1 P15121 2/20 0.64
TTR P02766 1/20 0.62

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
SCHEMBL7048864 1.00 MET (0.83) METALOX5CA12CA4CA6
SCHEMBL20914995 0.87 ALOX5 (1.00) METALOX5TTR
Benzyl Ferulate SCHEMBL16155887 0.87 CA12 (1.00) METALOX5CA12CA4CA6
Benzyl Ferulate SCHEMBL15419733 0.87 CA12 (1.00) METALOX5CA12CA4CA6
SCHEMBL15384085 0.87 CA12 (0.81) METCA12CA4CA6CA5A
SCHEMBL11210494 0.86 MET (0.69) METALOX5CA12CA4CA6
SCHEMBL20914989 0.85 ALOX5 (1.00) METALOX5AKR1B10AKR1B1TTR
SCHEMBL16155888 0.85 CA12 (0.82) METALOX5CA12CA4CA6
SCHEMBL28869313 0.85 CA12 (0.82) METALOX5CA12CA4CA6
SCHEMBL9550145 0.84 CA12 (0.76) CA12CA4CA6CA5ACA7

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0933378-B1 Quinolinone glycoside, production process, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2003-04-09 EP disclosed
US-6242425-B1 SINAPIC ACID GLYCOSIDE INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-05 US disclosed
WO-1999062334-A1 METHODS FOR CONTROLLING A PEST POPULATION SUMMUS GROUP, LTD. (US) 1999-12-09 WO disclosed
WO-1999056544-A1 HERBICIDAL COMPOSITIONS SUMMUS GROUP, LTD. (US) 1999-11-11 WO disclosed
EP-0933378-A1 Quinolinone glycoside, production process, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-04 EP disclosed