SCHEMBL7591545

SCHEMBL7591545

CC(=O)Nc1ccc(S(=O)(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
NPSR1 Q6W5P4 2/20 0.61
PKM P14618 2/20 0.61
POLB P06746 1/20 0.61
ALDH3A1 P30838 2/20 0.60
CASP6 P55212 1/20 0.56
ALDH1A1 P00352 7/20 0.55
KMT2A Q03164 3/20 0.55
LMNA P02545 2/20 0.55
MEN1 O00255 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
HTT P42858 2/20 0.55
TDP1 Q9NUW8 2/20 0.54
GAA P10253 2/20 0.51
HPGD P15428 1/20 0.49
ABCC9 O60706 1/20 0.47
ABCC8 Q09428 1/20 0.47
KCNJ11 Q14654 1/20 0.47
KCNJ8 Q15842 1/20 0.47
CA1 P00915 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
SCHEMBL18653823 0.89 MAPT (0.62) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL11629310 0.88 ALDH3A1 (0.76) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL5841267 0.87 PKM (0.60) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL11686855 0.87 CA1 (0.64) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL11323706 0.86 ALDH3A1 (0.81) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL5786327 0.83 KMT2A (0.78) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL10502186 0.83 HCAR3 (0.58) MAPTPKMPOLBALDH3A1CASP6
SCHEMBL7813230 0.82 CASP6 (0.57) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL2282371 0.81 MAPT (0.68) MAPTNPSR1PKMPOLBALDH3A1
SCHEMBL1532370 0.80 MAPT (0.66) MAPTNPSR1PKMPOLBALDH1A1

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-0780376-B1 2-Acylamino-9-aryl-acridines, process for their preparation, and light-sensitive compositions containing them AGFA GEVAERT (BE) 2002-10-16 EP disclosed
US-4207261-A Process for preparing o-phenylenediamine MAGYAR ASVANYOLAJ ES FOLDGAZ KISERLETI INTEZET (HU) 1980-06-10 US disclosed