SCHEMBL6022595

SCHEMBL6022595

Nc1ccc2cc(S(=O)(=O)O)ccc2c1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.56
CASP6 P55212 4/20 0.56
CYP2C9 P11712 4/20 0.56
CYP2C19 P33261 4/20 0.56
ALDH1A1 P00352 3/20 0.56
NT5E P21589 2/20 0.47
SNCA P37840 1/20 0.47
NSD2 O96028 2/20 0.44
DUSP3 P51452 2/20 0.44
PTPN5 P54829 2/20 0.44
PTPN11 Q06124 2/20 0.44
CASP7 P55210 1/20 0.44
SENP2 Q9HC62 4/20 0.42
SUMO2 P61956 3/20 0.42
SUMO1 P63165 3/20 0.42
SENP7 Q9BQF6 3/20 0.42
SENP3 Q9H4L4 3/20 0.42
SENP1 Q9P0U3 3/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TSHR P16473 3/20 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
SCHEMBL5561318 0.79 CASP6 (0.48) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL6051291 0.78 ALDH1A1 (0.67) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL1755142 0.76 HSD17B10 (0.65) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL9464148 0.76 CASP6 (0.65) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL1680177 0.76 ALDH1A1 (0.47) HSD17B10CYP2C9CYP2C19ALDH1A1CASP7
SCHEMBL9568749 0.76 TSHR (0.48) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL10966987 0.76 TSHR (0.48) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL9278536 0.76 TTR (0.60) ALDH1A1SNCANSD2SENP2SUMO2
SCHEMBL6530355 0.75 ALDH1A1 (0.63) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1
SCHEMBL7421695 0.75 ALDH1A1 (0.63) HSD17B10CASP6CYP2C9CYP2C19ALDH1A1

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
WO-2006137891-A2 MEMBRANE WITH NANOCHANNELS FOR DETECTION OF MOLECULES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2006-12-28 WO disclosed
EP-1478783-A4 COMPOSITIONS AND METHODS FOR ROLLING CIRCLE AMPLIFICATION GE HEALTHCARE BIO SCIENCES AB (SE) 2006-12-27 EP disclosed
EP-1478783-A2 COMPOSITIONS AND METHODS FOR ROLLING CIRCLE AMPLIFICATION Amersham Biosciences AB (SE) 2004-11-24 EP disclosed
EP-1439910-A2 SYSTEM AND METHODS FOR MIXING WITHIN A MICROFLUIDIC DEVICE Motorola, Inc. (US) 2004-07-28 EP disclosed
WO-2003093168-A2 SYSTEM AND METHODS FOR MIXING WITHIN A MICROFLUIDIC DEVICE MOTOROLA, INC. (US) 2003-11-13 WO disclosed
WO-2003076666-A1 COMPOSITIONS AND METHODS FOR DETECTING NUCLEIC ACID METHYLATION NAXCOR (US) 2003-09-18 WO disclosed
WO-2003066817-A2 COMPOSITIONS AND METHODS FOR ROLLING CIRCLE AMPLIFICATION AMERSHAM BIOSCIENCES AB (SE) 2003-08-14 WO disclosed