SCHEMBL22474150

SCHEMBL22474150

CC(=O)Nc1cc(N(CCOC(C)=O)CCOC(C)=O)ccc1/N=N/c1cc(SC#N)c([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.37
MAPT P10636 3/20 0.37
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 1/20 0.33
GALR2 O43603 1/20 0.33
MITF O75030 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HPGD P15428 1/20 0.33
XBP1 P17861 1/20 0.33
CCR6 P51684 1/20 0.33
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PDE7A Q13946 1/20 0.31
THRB P10828 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL22474126 0.92 MAPT (0.37) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22474135 0.89 MAPT (0.37) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22474124 0.88 MAPT (0.40) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22476596 0.86 MAPT (0.40) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22474138 0.85 MAPT (0.37) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22474136 0.82 MAPT (0.38) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22474156 0.82 HTT (0.35) NPSR1MAPTKMT2AALDH1A1HTT
SCHEMBL14341937 0.78 SMN1; SMN2 (0.42) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL22474173 0.78 MAPT (0.41) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL15693751 0.78 SMN1; SMN2 (0.42) NPSR1MAPTKMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3715424-A1 HIGH WET FAST DISPERSE DYE MIXTURES OF N-[4-(5-THIOCYANATO-2,4-DINITRO-PHENYLAZO)-PHENYL]-AMINE DERIVATIVES AND N-[4-(4-NITRO-PHENYLAZO)-PHENYL]-AMINE DERIVATIVES DyStar Colours Distribution GmbH (DE) 2020-09-30 EP disclosed