SCHEMBL8600883

SCHEMBL8600883

CCCCCC(=O)c1ncccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
FAAH O00519 9/20 0.46
DAGLA Q9Y4D2 5/20 0.45
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CDC25B P30305 1/20 0.41

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
SCHEMBL8600968 0.80 KMT2A (0.50) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8601179 0.80 ESR1 (0.53) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8600798 0.78 FAAH (0.46) FAAHDAGLAALDH1A1MAPT
SCHEMBL9439903 0.77 KMT2A (0.58) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL19726396 0.77 MEN1 (0.59) FAAHDAGLAKMT2AMEN1ALDH1A1
SCHEMBL20626696 0.77 MEN1 (0.59) FAAHDAGLAKMT2AMEN1ALDH1A1
SCHEMBL1244915 0.77 FAAH (0.50) FAAHDAGLA
SCHEMBL8600065 0.76 CDC25B (0.42) FAAHDAGLAALDH1A1CDC25B
SCHEMBL3381186 0.76 ALDH1A1 (0.51) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL305884 0.75 PDE10A (0.53) LMNAKMT2AKDM4EMEN1ALDH1A1

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