SCHEMBL8568442

SCHEMBL8568442

Nc1nc2ccccc2c(C(=O)NCc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 2/20 0.51
POLB P06746 1/20 0.48
HPGD P15428 2/20 0.47
LMNA P02545 3/20 0.47
GALR3 O60755 1/20 0.47
NR2F2 P24468 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 2/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TACR3 P29371 1/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
KMT2A Q03164 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL8599626 0.85 HPGD (0.50) KDM4EL3MBTL1MAPTPOLBHPGD
SCHEMBL28460390 0.84 EGFR (0.55) KDM4EL3MBTL1MAPTPOLBHPGD
SCHEMBL8562632 0.83 L3MBTL1 (0.52) KDM4EL3MBTL1POLBHPGDLMNA
SCHEMBL8599924 0.83 TLR7 (0.47) KDM4EL3MBTL1MAPTPOLBHPGD
SCHEMBL8564023 0.82 MAPT (0.44) KDM4EMAPTPOLBHPGDLMNA
SCHEMBL8568375 0.82 PDE10A (0.46) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL8560819 0.81 HPGD (0.53) KDM4EL3MBTL1MAPTHPGDTACR3
SCHEMBL8559921 0.80 IKBKB (0.42) KDM4EL3MBTL1MAPTPOLBMAPK1
SCHEMBL8563794 0.80 MGMT (0.50) KDM4EMAPTPOLBHPGDLMNA
SCHEMBL8568405 0.79 HSD17B10 (0.52) KDM4EMAPTPOLBHPGDLMNA

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