SCHEMBL7651109

SCHEMBL7651109

Nc1cc2ccc(S(=O)(=O)O)cc2cc1S(=O)(=O)O.[Na]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
HSD17B10 Q99714 3/20 0.62
CASP6 P55212 3/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
NT5E P21589 4/20 0.50
SNCA P37840 2/20 0.46
SUMO2 P61956 2/20 0.46
SUMO1 P63165 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SENP2 Q9HC62 2/20 0.46
TSHR P16473 2/20 0.44
TDP1 Q9NUW8 1/20 0.43
NSD2 O96028 2/20 0.42
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42
PTPN11 Q06124 1/20 0.42
SENP3 Q9H4L4 1/20 0.42
SENP1 Q9P0U3 1/20 0.42
KDM4E B2RXH2 2/20 0.42

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
SCHEMBL1755222 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL29624161 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL1146228 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL30639252 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL11598411 0.98 ALDH1A1 (0.60) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL28071057 0.98 ALDH1A1 (0.60) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6234561 0.89 CASP6 (0.68) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL7692151 0.89 ALDH1A1 (0.65) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL7651104 0.88 ALDH1A1 (0.53) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL10704767 0.87 ALDH1A1 (0.56) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115738767-A Chiral separation membrane with spiral pore channel 天津工业大学 2023-03-07 CN claimed
US-5500668-A INK JET PRINTING XEROX CORPORATION (US) 1996-03-19 US claimed
CN-117281115-A Free radical generating catalyst, method for producing free radical, method for producing oxidation reaction product, pharmaceutical agent, and agricultural and livestock pharmaceutical agent 株式会社ACENET 2023-12-26 CN disclosed
CN-116903874-A Preparation method of cucurbituril rare earth supermolecule hydrogel 南京信息工程大学 2023-10-20 CN disclosed
WO-2023190598-A1 COMPOSITION アース製薬株式会社 2023-10-05 WO disclosed
CN-116322332-A Antipathogenic agent, antibacterial agent, antiviral agent, pathogen treatment device, method for producing antipathogenic agent, antibacterial method, virus inactivation method, and pathogen treatment method 株式会社ACENET 2023-06-23 CN disclosed
CN-115738767-A Chiral separation membrane with spiral pore channel 天津工业大学 2023-03-07 CN disclosed
CN-114501996-A Chemical, method for producing chemical, and method for purifying water 株式会社ACENET 2022-05-13 CN disclosed
CN-110769931-A Catalyst for generating free radical, method for producing oxidation reaction product, chemical, and chemical for agricultural and livestock use 株式会社ACENET 2020-02-07 CN disclosed
US-6350795-B1 ACOUSTIC PHASE-CHANGE CONDUCTIVE INK CONTAINING LOW MOLECULAR WEIGHT OXYALKYLENE SEGMENTS COMPLEXED WITH UREA DERIVATIVES XEROX CORPORATION 2002-02-26 US disclosed
US-6096125-A Ink compositions XEROX CORPORATION (US) 2000-08-01 US disclosed
EP-0388356-B1 Ultraviolet absorbing lenses and methods of making the same CIBA GEIGY AG (CH) 1998-07-08 EP disclosed
US-5500668-A INK JET PRINTING XEROX CORPORATION (US) 1996-03-19 US disclosed
EP-0388356-A2 Ultraviolet absorbing lenses and methods of making the same CIBA-GEIGY AG (CH) 1990-09-19 EP disclosed
US-4129591-A INHIBITORS OF THE COMPLEMENT SYSTEM AMERICAN CYANAMID COMPANY (US) 1978-12-12 US disclosed