SCHEMBL7843604

SCHEMBL7843604

C=CS(=O)(=O)CC[N]c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
CYP2D6 P10635 1/20 0.35
CA2 P00918 1/20 0.35
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7760688 0.89 CA2 (0.33) POLBCYP2D6CA2
SCHEMBL7839192 0.82 CA12 (0.34) CA2ALDH1A1
SCHEMBL7843599 0.81 TDP1 (0.46) POLBCYP2D6TSHRSMN1; SMN2ALDH1A1
SCHEMBL7843123 0.78 APLNR (0.44) CA2PTGS1PTGS2TSHRSMN1; SMN2
SCHEMBL7840794 0.76 CYP2C9 (0.34) SMN1; SMN2ALDH1A1
SCHEMBL1720603 0.75 POLB (0.42) POLBCYP2D6CA2PTGS1PTGS2
SCHEMBL7840012 0.73 CA12 (0.33) CA2ALDH1A1
SCHEMBL7839760 0.71 TDP1 (0.43) POLBCYP2D6TSHRSMN1; SMN2ALDH1A1
SCHEMBL7759866 0.71 TDP1 (0.38) POLBCYP2D6CA2TSHRSMN1; SMN2
SCHEMBL7801205 0.70 CA2 (0.32) POLBCYP2D6CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773264-B1 Process for the preparation of triphenodioxazine dyes amidated on both sides and triphenodioxazine dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-10-10 EP 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
US-5944854-A LEUCO DYES DYSTAR TEXTILFARBEN GMBH & CO. (DE) 1999-08-31 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
US-5696258-A REDUCING TO LEUCO FORM; REOXIDATION DYSTAR TEXTILFARBEN GMBH (DE) 1997-12-09 US disclosed
EP-0773264-A1 Process for the preparation of triphenodioxazine dyes amidated on both sides and triphenodioxazine dyes DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-05-14 EP disclosed
US-5539088-A PROVIDE DYEINGS IN BRILLIANT SHADES WITH GOOD FASTNESS PROPERTIES AND HIGH DEGREE OF FIXATION HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed