SCHEMBL6530355

SCHEMBL6530355

Cc1c(N)ccc2cc(S(=O)(=O)O)ccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.63
CASP6 P55212 3/20 0.63
HSD17B10 Q99714 3/20 0.63
CYP2C9 P11712 2/20 0.63
CYP2C19 P33261 1/20 0.63
NT5E P21589 4/20 0.51
SUMO2 P61956 2/20 0.51
SUMO1 P63165 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
SENP2 Q9HC62 2/20 0.51
SENP3 Q9H4L4 1/20 0.51
SENP1 Q9P0U3 1/20 0.51
NSD2 O96028 2/20 0.47
DUSP3 P51452 1/20 0.47
PTPN5 P54829 1/20 0.47
PTPN11 Q06124 1/20 0.47
CYP1A2 P05177 2/20 0.47
SNCA P37840 2/20 0.46
TSHR P16473 2/20 0.41
PHLPP2 Q6ZVD8 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
SCHEMBL6051291 0.86 ALDH1A1 (0.67) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL18937543 0.84 SUMO2 (0.52) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL11128939 0.83 ALDH1A1 (0.58) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL30218699 0.83 CASP6 (0.53) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL18936305 0.83 CASP6 (0.53) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL3487195 0.83 ALDH1A1 (0.53) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL1755142 0.81 HSD17B10 (0.65) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL9464148 0.81 CASP6 (0.65) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL7421695 0.80 ALDH1A1 (0.63) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19
SCHEMBL29013483 0.80 ALDH1A1 (0.58) ALDH1A1CASP6HSD17B10CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110199031-A Method for designing a set of polynucleotide sequences for analyzing specific events in a genetic region of interest 基因组影像公司 2019-09-03 CN disclosed
EP-2739732-A2 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE Illumina, Inc. (US) 2014-06-11 EP disclosed
WO-2013137922-A2 FUNCTIONALIZATION AND PURIFICATION OF MOLECULES BY REVERSIBLE GROUP EXCHANGE ILLUMINA, INC. (US) 2013-09-19 WO disclosed
EP-1583972-A2 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS HK Pharmaceuticals, Inc. (US) 2005-10-12 EP disclosed
WO-2004064972-A9 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS HK PHARMACEUTICALS INC (US) 2004-09-16 WO disclosed
WO-2004064972-A2 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS HK PHARMACEUTICALS, INC. (US) 2004-08-05 WO 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
US-6268158-B1 GENERATING THERMAL DENATURATION CURVE 3-DIMENSIONAL PHARMACEUTICALS, INC. 2001-07-31 US disclosed
EP-0914608-A1 MICROPLATE THERMAL SHIFT ASSAY AND APPARATUS FOR LIGAND DEVELOPMENT AND MULTI-VARIABLE PROTEIN CHEMISTRY OPTIMIZATION 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1999-05-12 EP disclosed
WO-1997042500-A1 MICROPLATE THERMAL SHIFT ASSAY AND APPARATUS FOR LIGAND DEVELOPMENT AND MULTI-VARIABLE PROTEIN CHEMISTRY OPTIMIZATION 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1997-11-13 WO disclosed