SCHEMBL8568162

SCHEMBL8568162

Nc1ccnc(CCl)c1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
KMT2A Q03164 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
HTT P42858 7/20 0.36
LMNA P02545 6/20 0.36
MAPT P10636 5/20 0.36
KDM4E B2RXH2 1/20 0.36
MITF O75030 1/20 0.36
NOD2 Q9HC29 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MGMT P16455 2/20 0.35
ALDH1A1 P00352 3/20 0.34
NPC1 O15118 2/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
XBP1 P17861 1/20 0.34
RAB9A P51151 1/20 0.34
TLR9 Q9NR96 1/20 0.34

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
SCHEMBL3874226 0.79 MEN1 (0.36) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8840851 0.79 HTT (0.43) MEN1KMT2AHTTLMNAMAPT
SCHEMBL8567046 0.78 HTT (0.47) MEN1KMT2AHTTLMNAMAPT
SCHEMBL203785 0.77 MEN1 (0.41) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL30622636 0.77 MEN1 (0.41) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8561596 0.77 MEN1 (0.41) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8597378 0.76 MEN1 (0.41) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL8560653 0.76 MEN1 (0.37) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL3688848 0.76 MAPT (0.47) MEN1USP2KMT2AKEAP1NFE2L2
SCHEMBL28203110 0.75 MEN1 (0.40) MEN1USP2KMT2AKEAP1NFE2L2

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