SCHEMBL8080694

SCHEMBL8080694

O=C(CCl)c1ccc(O)c(O)c1.Oc1cccc(Cl)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.43
ALOX15 P16050 1/20 0.41
ALPG P10696 4/20 0.41
ALPL P05186 2/20 0.41
PLAA Q9Y263 1/20 0.41
GAA P10253 3/20 0.41
POLB P06746 2/20 0.41
HIF1A Q16665 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
TRPA1 O75762 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
PTGS2 P35354 1/20 0.41
CA7 P43166 1/20 0.41

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
SCHEMBL16010437 0.83 CA12 (0.56) GSK3BALPGALPLPLAAGAA
SCHEMBL29389757 0.83 CA12 (0.56) GSK3BALPGALPLPLAAGAA
SCHEMBL43409 0.83 CA12 (0.56) GSK3BALPGALPLPLAAGAA
Catechol SCHEMBL20361612 0.81 GSK3B (0.50) GSK3BALPGALPLPLAAGAA
Boric Acid SCHEMBL10752697 0.79 CA12 (0.50) GSK3BALPGALPLPLAAGAA
SCHEMBL8768769 0.77 GSK3B (0.55) GSK3BHIF1AKDM4ETRPA1ALDH1A1
SCHEMBL21055987 0.77 GSK3B (0.55) GSK3BHIF1AKDM4ETRPA1ALDH1A1
SCHEMBL9768052 0.73 ALPG (0.50) ALPGALPLPLAAGAAPOLB
SCHEMBL71077 0.72
SCHEMBL37816440 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2000254690-A METHOD FOR PREVENTING STICKING OF SILICA BASE SCALE KURITA WATER IND LTD 2000-09-19 JP disclosed