SCHEMBL758181

SCHEMBL758181

Cc1cc(C(=O)O)c(S(=O)(=O)O)c(C(=O)O)c1C.[LiH]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 5/20 0.40
HSD17B10 Q99714 4/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
PHLPP2 Q6ZVD8 1/20 0.39
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2D6 P10635 1/20 0.36
GAA P10253 1/20 0.36
LDHA P00338 1/20 0.35
LDHB P07195 1/20 0.35
FABP4 P15090 1/20 0.35
CYP3A4 P08684 2/20 0.34
ACHE P22303 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL985182 0.98 KDM4E (0.41) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL9246637 0.97 KDM4E (0.40) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL3912717 0.97 KDM4E (0.40) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL271087 0.84 ALDH1A1 (0.41) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL2470422 0.84 KDM4E (0.44) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL16425819 0.84 KDM4E (0.43) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL11373331 0.83 KDM4E (0.40) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL27772745 0.83 PHLPP2 (0.39) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL464905 0.81 KDM4E (0.39) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL270432 0.81 ALDH1A1 (0.41) KDM4EALDH1A1HSD17B10HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368404-A1 SULFOISOPHTHALIC ACID SOLUTION AND PROCESS THEREWITH E. I. du Pont de Nemours and Company (US) 2003-12-10 EP claimed
US-20020169273-A1 Sulfoisophthalic acid solution and process therewith E. I. DU PONT DE NEMOURS AND COMPANY 2002-11-14 US claimed
US-6479619-B1 PRODUCING A PARTIALLY ESTERIFIED ALKALI METAL SULFOISOPHTHALIC ACID IN A GLYCOL; CAN BE MADE IMMEDIATELY PRIOR TO USE; COPOLYMERIZING WITH TEREPHTHALIC ACID AND A GLYCOL TO FORM A POLYESTER E. I. DU PONT DE NEMOURS AND COMPANY 2002-11-12 US claimed
WO-2002074834-A1 SULFOISOPHTHALIC ACID SOLUTION AND PROCESS THEREWITH E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-09-26 WO claimed
EP-2264543-B1 Super low melt and ultra low melt toners containing crystalline sulfonated polyester XEROX CORP (US) 2012-03-21 EP disclosed
EP-2264543-A1 Super low melt and ultra low melt toners containing crystalline sulfonated polyester Xerox Corporation (US) 2010-12-22 EP disclosed
US-7312011-B2 Super low melt and ultra low melt toners containing crystalline sulfonated polyester XEROX CORPORATION (US) 2007-12-25 US disclosed
EP-1684124-A2 Super low melt and ultra low melt toners containing crystalline sulfonated polyester Xerox Corporation (US) 2006-07-26 EP disclosed
US-20060160010-A1 Super low melt and ultra low melt toners containing crystalline sulfonated polyester XEROX CORPORATION (US) 2006-07-20 US disclosed
US-5407981-A Reacting ester of dibasic acid, short chain diol,long chain polyglycol, alkali salt of dialkylsulfoisophthalate, stabilizers and alkali salt of phenol; for extrusion, blow molding CHEIL SYNTHETICS INC. (KR) 1995-04-18 US disclosed
EP-0605260-A1 Preparation of polyether ester elastomers having high melt viscosities and crystallization CHEIL SYNTHETICS INC. (KR) 1994-07-06 EP disclosed