SCHEMBL8560653

SCHEMBL8560653

COCCc1nccc(N)c1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 7/20 0.37
ALDH1A1 P00352 3/20 0.37
POLB P06746 2/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 3/20 0.35
KDM4E B2RXH2 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
USP2 O75604 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
MGMT P16455 1/20 0.34
HTT P42858 2/20 0.33
NPY1R P25929 1/20 0.33
NPC1 O15118 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL8572912 0.79 MGMT (0.39) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL8597378 0.79 MEN1 (0.41) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL28203110 0.78 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL8565117 0.77 MAPT (0.39) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL8568162 0.76 MEN1 (0.38) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL2552279 0.76 IKBKB (0.37) MAPTALDH1A1LMNATDP1SMN1; SMN2
SCHEMBL30676086 0.76 IKBKB (0.37) MAPTALDH1A1LMNATDP1SMN1; SMN2
SCHEMBL30622686 0.73 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL1959760 0.73 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL8561983 0.73 ALDH1A1 (0.50) MEN1KMT2AMAPTALDH1A1POLB

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