SCHEMBL5528855

SCHEMBL5528855

Oc1ccccc1Oc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.91

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.60
NR1H2 P55055 1/20 0.60
BAX Q07812 1/20 0.60
TSHR P16473 2/20 0.55
MAOA P21397 1/20 0.54
TTR P02766 2/20 0.53
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
TP53 P04637 1/20 0.48
PNLIP P16233 1/20 0.47
HRH1 P35367 1/20 0.47
CTNNB1 P35222 1/20 0.47
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46

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
SCHEMBL9344917 0.95 TSHR (0.52) LTA4HNR1H2BAXTSHRMAOA
SCHEMBL29449754 0.95 TTR (0.57) LTA4HNR1H2BAXTSHRMAOA
SCHEMBL260447 0.95 TTR (0.57) LTA4HNR1H2BAXTSHRMAOA
SCHEMBL29024081 0.93 CA2 (0.54) LTA4HNR1H2BAXTSHRMAOA
SCHEMBL9588307 0.91 TTR (0.53) LTA4HNR1H2BAXTSHRTTR
Ethylene SCHEMBL27892819 0.91 TTR (0.53) LTA4HNR1H2BAXTSHRTTR
SCHEMBL9588301 0.90 TTR (0.53) LTA4HNR1H2BAXTSHRTTR
Bicarbonate SCHEMBL6919886 0.89 TTR (0.59) LTA4HNR1H2BAXTSHRTTR
Biphenyl SCHEMBL28813894 0.89 TTR (0.52) LTA4HNR1H2BAXTSHRTTR
Formaldehyde SCHEMBL9420440 0.89 TTR (0.55) LTA4HNR1H2BAXTSHRTTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5219477-A Containing organometallic salts and inorganic metal borates; fromo reactinmetal hydroxide with phenols or aromatic carboxylic acid THE DOW CHEMICAL COMPANY (US) 1993-06-15 US claimed
EP-1400548-B1 Novel aromatic sulfonic acid ester derivative, polyarylene, polyarylene having sulfonic acid group and process for producing the same, and polymer solid electrolyte and proton-conductive membrane JSR CORP (JP) 2007-07-11 EP disclosed
US-7163988-B2 Aromatic sulfonic acid ester derivative, polyarylene, polyarylene having sulfonic acid group and process for producing the same, and polymer solid electrolyte and proton-conductive membrane JSR CORPORATION (JP) 2007-01-16 US disclosed
EP-1400548-A1 Novel aromatic sulfonic acid ester derivative, polyarylene, polyarylene having sulfonic acid group and process for producing the same, and polymer solid electrolyte and proton-conductive membrane JSR Corporation (JP) 2004-03-24 EP disclosed
US-20040044166-A1 Novel aromatic sulfonic acid ester derivative, polyarylene, polyarylene having sulfonic acid group and process for producing the same, and polymer solid electrolyte and proton-conductive membrane JSR CORPORATION (JP) 2004-03-04 US disclosed
US-5219477-A Containing organometallic salts and inorganic metal borates; fromo reactinmetal hydroxide with phenols or aromatic carboxylic acid THE DOW CHEMICAL COMPANY (US) 1993-06-15 US disclosed