SCHEMBL7829819

SCHEMBL7829819

Nc1cc([N+](=O)[O-])ccc1Nc1cccc(S(=O)(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.65
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
GFER P55789 2/20 0.65
TDP1 Q9NUW8 2/20 0.59
GAA P10253 2/20 0.59
KDM4E B2RXH2 1/20 0.59
ATM Q13315 1/20 0.59
NT5E P21589 1/20 0.51
CA2 P00918 5/20 0.48
CA1 P00915 4/20 0.48
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
RECQL P46063 1/20 0.48
DUSP3 P51452 1/20 0.48
PTPN5 P54829 1/20 0.48
PTPN11 Q06124 1/20 0.48
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47

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
SCHEMBL7839318 0.87 MAPT (0.72) MAPTMEN1KMT2AGFERTDP1
SCHEMBL10628214 0.86 MAPT (0.54) MAPTMEN1KMT2AGFERTDP1
SCHEMBL9226628 0.81 HPGD (0.58) MEN1KMT2AGAANT5ECA2
SCHEMBL10721756 0.81 ALDH1A1 (0.56) MAPTMEN1KMT2AGFERTDP1
SCHEMBL10534828 0.81 NT5E (0.58) MAPTMEN1KMT2AGFERTDP1
SCHEMBL11226639 0.80 MAPT (0.60) MAPTMEN1KMT2ATDP1POLB
SCHEMBL9622296 0.80 MAPT (0.54) MAPTMEN1KMT2ATDP1GAA
SCHEMBL6582107 0.80 MAPT (1.00) MAPTMEN1KMT2AGFERTDP1
SCHEMBL7838995 0.79 MAPT (0.55) MAPTMEN1KMT2AGFERTDP1
SCHEMBL10626357 0.79 MAPT (0.71) MAPTMEN1KMT2AGFERTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-5539088-A PROVIDE DYEINGS IN BRILLIANT SHADES WITH GOOD FASTNESS PROPERTIES AND HIGH DEGREE OF FIXATION HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed
EP-0675172-A2 Water-solable azo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-04 EP disclosed
EP-0220613-B1 DIRECT HAIR DYEING COMPOSITION CONTAINING DERIVATIVES OF NITRODIPHENYL AMINE Henkel Kommanditgesellschaft auf Aktien (DE) 1991-05-08 EP disclosed
US-4756716-A Cosmetic carrier, surfactant, nitrodiphenylamine hair dyes HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1988-07-12 US disclosed
EP-0220613-A1 Direct hair dyeing composition containing derivatives of nitrodiphenyl amine Henkel Kommanditgesellschaft auf Aktien (DE) 1987-05-06 EP disclosed