SCHEMBL1864162

SCHEMBL1864162

Oc1ccc(O)c(-c2ccc(Oc3ccccc3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.59
NR1H2 P55055 1/20 0.59
BAX Q07812 1/20 0.59
GSTP1 P09211 1/20 0.55
ALOX5 P09917 1/20 0.50
BACE1 P56817 2/20 0.47
ESR2 Q92731 4/20 0.47
GPR84 Q9NQS5 1/20 0.46
PELI1 Q96FA3 2/20 0.46
ESR1 P03372 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PTPN1 P18031 1/20 0.44
THRA P10827 2/20 0.44
THRB P10828 2/20 0.44
TSHR P16473 1/20 0.43
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 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
1,4-Dimethoxybenzene SCHEMBL7460138 0.88 BACE1 (0.59) LTA4HNR1H2BAXGSTP1ALOX5
SCHEMBL14283896 0.87 GSTP1 (0.64) LTA4HNR1H2BAXGSTP1BACE1
SCHEMBL9504663 0.83 ALOX5 (0.65) ALOX5BACE1ESR2PELI1ESR1
SCHEMBL29458798 0.82 ALOX5 (0.71) ALOX5BACE1ESR2PELI1ESR1
SCHEMBL68984 0.82 ALOX5 (0.71) ALOX5BACE1ESR2PELI1ESR1
SCHEMBL589665 0.81 BACE1 (0.60) LTA4HNR1H2BAXGSTP1ALOX5
SCHEMBL13861252 0.80 PELI1 (0.53) ALOX5BACE1ESR2PELI1ESR1
Ethyne SCHEMBL29161596 0.79 ALOX5 (0.61) ALOX5BACE1ESR2PELI1ESR1
SCHEMBL9149016 0.79 ALOX5 (0.59) LTA4HNR1H2BAXGSTP1ALOX5
Phenol SCHEMBL28262809 0.79 ALOX5 (0.65) ALOX5BACE1ESR2PELI1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046862-B1 POLY(ARYL ETHER) WITH PENDENT SULFONIC ACID PHENYL GROUPS CA NAT RESEARCH COUNCIL (CA) 2013-02-13 EP disclosed
US-7947800-B2 Poly(aryl ether) with pendent sulfonic acid phenyl groups NATIONAL RESEARCH COUNCIL OF CANADA 2011-05-24 US disclosed
CN-101225035-B Biphenol monomer containing anthracene benzophenone substituent as well as preparation method and use thereof UNIV JILIN 2010-06-09 CN disclosed
US-20090203806-A1 POLY(ARYL ETHER) WITH PENDENT SULFONIC ACID PHENYL GROUPS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2009-08-13 US disclosed
EP-2046862-A1 POLY(ARYL ETHER) WITH PENDENT SULFONIC ACID PHENYL GROUPS National Research Council of Canada (CA) 2009-04-15 EP disclosed
CN-101225035-A Biphenol monomer containing anthracene benzophenone substituent as well as preparation method and use thereof UNIV JILIN (CN) 2008-07-23 CN disclosed
WO-2008009102-A1 POLY(ARYL ETHER) WITH PENDENT SULFONIC ACID PHENYL GROUPS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2008-01-24 WO disclosed