SCHEMBL4598070

SCHEMBL4598070

O=S(=O)(O)c1ccc(N=Nc2cccc(S(=O)(=O)O)c2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.72
CYP2D6 P10635 1/20 0.72
CA12 O43570 5/20 0.58
CA2 P00918 5/20 0.58
CA9 Q16790 5/20 0.58
GLO1 Q04760 2/20 0.58
SENP3 Q9H4L4 2/20 0.56
SENP2 Q9HC62 2/20 0.56
SENP1 Q9P0U3 2/20 0.56
SUMO2 P61956 1/20 0.56
SUMO1 P63165 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
TDP1 Q9NUW8 2/20 0.55
KMT2A Q03164 2/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
MAPK1 P28482 1/20 0.55
TSHR P16473 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL4598066 1.00 POLB (0.72) POLBCYP2D6CA12CA2CA9
Nitrogen SCHEMBL8634848 0.95 POLB (0.66) POLBCYP2D6CA12CA2CA9
SCHEMBL3308193 0.92 SENP3 (0.62) POLBCYP2D6CA12CA2CA9
SCHEMBL3308195 0.92 SENP3 (0.62) POLBCYP2D6CA12CA2CA9
SCHEMBL10800723 0.91 POLB (0.69) POLBCYP2D6CA12CA2CA9
SCHEMBL10800727 0.91 POLB (0.69) POLBCYP2D6CA12CA2CA9
SCHEMBL11859720 0.89 POLB (0.67) POLBCYP2D6CA12CA2CA9
SCHEMBL20885956 0.88 POLB (0.56) POLBCYP2D6CA12CA2CA9
SCHEMBL5888710 0.88 CA12 (0.73) POLBCYP2D6CA12CA2CA9
SCHEMBL5888705 0.88 CA12 (0.73) POLBCYP2D6CA12CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877495-A2 REACTIVE AZO DYES, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2008-01-16 EP disclosed
WO-2007006594-A2 REACTIVE AZO DYES, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-01-18 WO disclosed