SCHEMBL6561310

SCHEMBL6561310

Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(O)c23)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 5/20 0.62
CASP6 P55212 2/20 0.57
CTDSP1 Q9GZU7 1/20 0.57
HSD17B10 Q99714 3/20 0.54
MEN1 O00255 2/20 0.54
USP2 O75604 2/20 0.54
RECQL P46063 2/20 0.54
KMT2A Q03164 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
ALDH1A1 P00352 2/20 0.54
APEX1 P27695 1/20 0.51
HPSE Q9Y251 4/20 0.50
SIRT2 Q8IXJ6 2/20 0.50
SIRT1 Q96EB6 2/20 0.50
NSD2 O96028 2/20 0.50
CYP1A2 P05177 2/20 0.50
P2RY11 Q96G91 2/20 0.50
ENPP3 O14638 1/20 0.50
ENTPD3 O75355 1/20 0.50
NR1I2 O75469 1/20 0.50

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
SCHEMBL10949633 0.88 APEX1 (0.55) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL30818027 0.88 APEX1 (0.66) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL4649703 0.88 APEX1 (0.66) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL6560525 0.88 HSD17B10 (0.62) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL14557795 0.87 TIMP3 (0.71) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL11444032 0.86 TIMP3 (0.49) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL11588441 0.86 TIMP3 (0.49) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL11444030 0.85 TIMP3 (0.48) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL11512263 0.85 TIMP3 (0.68) TIMP3CASP6CTDSP1HSD17B10MEN1
SCHEMBL11049799 0.85 TIMP3 (0.48) TIMP3CASP6CTDSP1HSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1055710-B1 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DYSTAR TEXTILFARBEN GMBH & CO (DE) 2004-08-11 EP disclosed
US-6444794-B1 COMPLEXING WITH SUBSTRATE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2002-09-03 US disclosed
EP-0675172-B1 Water-solable azo compounds, process for their preparation and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-11 EP disclosed
EP-1055710-A1 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2000-11-29 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-5834601-A DYEING CELLULOSE, WOOL, POLYAMIDE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-10 US disclosed
US-5770709-A BRILLIANT COLOR SHADES, GOOD FASTNESS DURING USE AT HIGH DEGREE OF FIXING DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 1998-06-23 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-0548792-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0548795-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0299315-B1 REACTIVE DYES BAYER AG (DE) 1993-06-16 EP disclosed
EP-0542079-A2 Process for continuously reacting halogenopyrimidines with amines BAYER AG (DE) 1993-05-19 EP disclosed
EP-0542214-A2 Water-soluble fibre-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1993-05-19 EP disclosed
US-5091515-A PROCESS FOR THE PREPARATION OF SUBSTITUTED 2,4-DIAMINO-6-FLUORO-S-TRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
US-4988803-A Fiber reactive dyes for cotton, containing halotriazine and azo groups BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
US-4929719-A Fiber-reactive dyes containing an aniline radical which carries two different vinylsulfonyl moieties CIBA-GEIGY CORPORATION (US) 1990-05-29 US disclosed
EP-0299315-A2 Reactive dyes BAYER AG (DE) 1989-01-18 EP disclosed
EP-0024668-A2 Reactive dyestuffs and their use in dyeing and printing hydroxyl groups and nitrogen containing materials BAYER AG (DE) 1981-03-11 EP disclosed