SCHEMBL4296256

SCHEMBL4296256

C=CCc1ccccc1OS(=O)(=O)O.C=CCc1ccccc1Oc1ccccc1CC=C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 1/20 0.44
SELE P16581 1/20 0.44
VCAM1 P19320 1/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 4/20 0.41
ADRB2 P07550 4/20 0.40
ADRB1 P08588 3/20 0.40
HTR1A P08908 3/20 0.40
LMNA P02545 2/20 0.40
ADRA2C P18825 2/20 0.40
ADRB3 P13945 1/20 0.40
SLC6A2 P23975 1/20 0.40
BDKRB2 P30411 1/20 0.40
SLC6A4 P31645 1/20 0.40
ADRA1A P35348 1/20 0.40
HTR2B P41595 1/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL174594 0.95 ALDH1A1 (0.44) ALDH1A1KDM4EADRB2ADRB1HTR1A
Ammonia Solution, Strong SCHEMBL29695851 0.94 ALDH1A1 (0.43) ALDH1A1KDM4EADRB2ADRB1HTR1A
SCHEMBL7242609 0.94 ALDH1A1 (0.43) ALDH1A1KDM4EADRB2ADRB1HTR1A
Ammonia Solution, Strong SCHEMBL17304229 0.94 ALDH1A1 (0.43) ALDH1A1KDM4EADRB2ADRB1HTR1A
SCHEMBL10748390 0.94 ALDH1A1 (0.43) ALDH1A1KDM4EADRB2ADRB1HTR1A
Sulfuric Acid SCHEMBL1678480 0.90 ICAM1 (0.47) ICAM1SELEVCAM1ALDH1A1KDM4E
Sulfuric Acid SCHEMBL9770145 0.89 ICAM1 (0.46) ICAM1SELEVCAM1ALDH1A1KDM4E
Sulfuric Acid SCHEMBL11324839 0.89 ICAM1 (0.46) ICAM1SELEVCAM1ALDH1A1KDM4E
Sulfuric Acid SCHEMBL6263795 0.89 ICAM1 (0.46) ICAM1SELEVCAM1ALDH1A1KDM4E
Sulfuric Acid SCHEMBL1074745 0.89 ICAM1 (0.46) ICAM1SELEVCAM1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9360432-B2 Method for measuring triglyceride in low-density lipoprotein KYOWA MEDEX CO., LTD. (JP) 2016-06-07 US disclosed
US-20090226944-A1 METHOD FOR MEASURING TRIGLYCERIDE IN LOW-DENSITY LIPOPROTEIN AND KIT FOR MEASUREMENT KYOWA MEDEX CO., LTD. (JP) 2009-09-10 US disclosed