SCHEMBL8567404

SCHEMBL8567404

NS(=O)(=O)c1cc([N+](=O)[O-])nc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.45
MAPT P10636 7/20 0.45
KDM4E B2RXH2 4/20 0.45
HSD17B10 Q99714 3/20 0.45
HPGD P15428 2/20 0.45
PKM P14618 2/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
BLM P54132 1/20 0.45
PIM1 P11309 2/20 0.41
PIM3 Q86V86 2/20 0.41
CA2 P00918 2/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
MEN1 O00255 6/20 0.40
TDP1 Q9NUW8 4/20 0.40
GLA P06280 3/20 0.40
ALDH1A1 P00352 3/20 0.40
GRM6 O15303 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL8564388 0.85 ALDH1A1 (0.48) KMT2AMAPTKDM4EHSD17B10HPGD
SCHEMBL8560933 0.83 ALDH1A1 (0.51) KMT2AMAPTKDM4EHSD17B10HPGD
SCHEMBL8566513 0.81 CASP6 (0.44) KMT2AMAPTKDM4EMEN1TDP1
SCHEMBL8602040 0.78 KMT2A (0.42) KMT2AMAPTKDM4ECYP1A2PIM1
SCHEMBL8566984 0.78 CA1 (0.39) KMT2AMAPTHPGDCYP1A2CA2
SCHEMBL3956436 0.78 NCF1 (0.51) KMT2AMAPTKDM4EHSD17B10HPGD
SCHEMBL27542356 0.77 ALDH1A1 (0.42) KMT2AMAPTKDM4EHPGDPKM
SCHEMBL8562398 0.77 CYP19A1 (0.51) MAPTKDM4ECA9GLAALDH1A1
SCHEMBL8623968 0.76 MAPT (0.37) KMT2AMAPTKDM4EPIM1PIM3
SCHEMBL8598916 0.76 TXNRD1 (0.44) KMT2AMAPTKDM4ECYP1A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0735025-B1 Process for producing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1998-07-01 EP disclosed
US-5648496-A AMINATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-15 US disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed