SCHEMBL7583560

SCHEMBL7583560

Nc1ccc2cc(C(=O)O)ccc2c1S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.50
PTPN1 P18031 1/20 0.45
CYP2D6 P10635 1/20 0.43
HSD17B10 Q99714 4/20 0.41
CYP2C19 P33261 3/20 0.41
CYP2C9 P11712 2/20 0.41
ATIC P31939 1/20 0.41
ALDH1A1 P00352 4/20 0.41
LMNA P02545 1/20 0.41
CASP6 P55212 1/20 0.41
KDM4E B2RXH2 4/20 0.39
GRIN2D O15399 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2C Q14957 1/20 0.39
ERN1 O75460 1/20 0.38
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL4940575 0.83 ERN1 (0.48) PTPN1CYP2D6HSD17B10ALDH1A1KDM4E
SCHEMBL1791108 0.83 PTPN1 (0.54) CDC25BPTPN1CYP2D6HSD17B10ALDH1A1
SCHEMBL3888687 0.81 PTPN1 (0.53) CDC25BPTPN1CYP2D6HSD17B10ALDH1A1
SCHEMBL9845612 0.81 PTPN1 (0.53) CDC25BPTPN1CYP2D6HSD17B10ALDH1A1
SCHEMBL30046904 0.81 PTPN1 (0.53) PTPN1CYP2D6HSD17B10CYP2C19ALDH1A1
SCHEMBL9354745 0.80 CASP6 (0.50) CYP2D6HSD17B10CYP2C19CYP2C9ALDH1A1
SCHEMBL1755142 0.79 HSD17B10 (0.65) HSD17B10CYP2C19CYP2C9ALDH1A1CASP6
SCHEMBL6007565 0.78 PTPN1 (0.51) CDC25BPTPN1HSD17B10CYP2C19CYP2C9
SCHEMBL27999197 0.78 ALDH1A1 (0.46) CYP2D6HSD17B10CYP2C19CYP2C9ALDH1A1
SCHEMBL9725853 0.78 ALDH1A1 (0.38) CYP2D6HSD17B10CYP2C19CYP2C9ALDH1A1

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502893-A1 AZO COMPOUNDS AND THEIR USE AS DYES, 1-SULPHO-6-CARBOXYL-AMINO NAPHTHALINE, ITS USE AS A DIAZO COMPONENT AND PROCESS FOR THE PRODUCTION OF THESE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-16 EP claimed
WO-1991008265-A1 AZO COMPOUNDS AND THEIR USE AS DYES, 1-SULPHO-6-CARBOXYL-AMINO NAPHTHALINE, ITS USE AS A DIAZO COMPONENT AND PROCESS FOR THE PRODUCTION OF THESE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-13 WO claimed
EP-0957135-B1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2002-09-25 EP disclosed
EP-0838504-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-06-07 EP disclosed
US-6060591-A FOR DYEING A MATERIAL CONTAINING HYDROXY OR CARBOXAMIDE GROUPS OR BOTH DY STAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND K.G. (DE) 2000-05-09 US disclosed
US-6022956-A Water-soluble halotriazine-containing axo compounds, preparation thereof and use thereof as dyes DY STAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2000-02-08 US disclosed
EP-0957135-A1 Water-soluble halotriazine-containing azo compounds, preparation thereof and use thereof as dyes DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1999-11-17 EP disclosed
US-5834601-A DYEING CELLULOSE, WOOL, POLYAMIDE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-10 US disclosed
EP-0848042-A2 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1998-06-17 EP disclosed
EP-0838504-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1998-04-29 EP disclosed
EP-0629667-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AG (DE) 1998-02-25 EP disclosed
EP-0507801-A1 AZO COMPOUNDS, PROCESS FOR PRODUCING THEM AND THEIR USE AS COLORANTS. HOECHST AG (DE) 1992-10-14 EP disclosed
EP-0502893-A1 AZO COMPOUNDS AND THEIR USE AS DYES, 1-SULPHO-6-CARBOXYL-AMINO NAPHTHALINE, ITS USE AS A DIAZO COMPONENT AND PROCESS FOR THE PRODUCTION OF THESE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-16 EP disclosed
EP-0502893-A1 AZO COMPOUNDS AND THEIR USE AS DYES, 1-SULPHO-6-CARBOXYL-AMINO NAPHTHALINE, ITS USE AS A DIAZO COMPONENT AND PROCESS FOR THE PRODUCTION OF THESE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-16 EP disclosed
WO-1992013037-A1 ANIONIC DISAZO DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-08-06 WO disclosed
WO-1991009914-A1 AZO COMPOUNDS, PROCESS FOR PRODUCING THEM AND THEIR USE AS COLORANTS HOECHST AKTIENGESELLSCHAFT (DE) 1991-07-11 WO disclosed
WO-1991009913-A1 AZO COMPOUNDS, PROCESS FOR PRODUCING THEM AND THEIR USE AS DYES HOECHST AKTIENGESELLSCHAFT (DE) 1991-07-11 WO disclosed
WO-1991009913-A1 AZO COMPOUNDS, PROCESS FOR PRODUCING THEM AND THEIR USE AS DYES HOECHST AKTIENGESELLSCHAFT (DE) 1991-07-11 WO disclosed
WO-1991008265-A1 AZO COMPOUNDS AND THEIR USE AS DYES, 1-SULPHO-6-CARBOXYL-AMINO NAPHTHALINE, ITS USE AS A DIAZO COMPONENT AND PROCESS FOR THE PRODUCTION OF THESE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-13 WO disclosed
WO-1991008265-A1 AZO COMPOUNDS AND THEIR USE AS DYES, 1-SULPHO-6-CARBOXYL-AMINO NAPHTHALINE, ITS USE AS A DIAZO COMPONENT AND PROCESS FOR THE PRODUCTION OF THESE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-13 WO disclosed