SCHEMBL8569814

SCHEMBL8569814

Nc1c(NCc2ccccc2)nc2ccccc2c1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.61
HTT P42858 2/20 0.57
EGFR P00533 2/20 0.57
LMNA P02545 3/20 0.56
MAPK1 P28482 2/20 0.56
HPGD P15428 1/20 0.56
ALDH1A1 P00352 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
APP P05067 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
POLB P06746 2/20 0.52
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA13 Q8N1Q1 1/20 0.50
RAD52 P43351 1/20 0.50
PDE5A O76074 1/20 0.49

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
SCHEMBL8597788 0.82 GSK3A (0.46) MAPTEGFRLMNAMAPK1HPGD
SCHEMBL8600079 0.80 SMN1; SMN2 (0.47) MAPTHTTEGFRLMNAMAPK1
SCHEMBL8563517 0.79 MAPT (0.61) MAPTHTTEGFRLMNAMAPK1
SCHEMBL8560819 0.79 HPGD (0.53) MAPTHPGD
SCHEMBL28460390 0.78 EGFR (0.55) MAPTHTTEGFRLMNAMAPK1
SCHEMBL8568939 0.78 VCAM1 (0.46) MAPTHTTEGFRLMNAMAPK1
SCHEMBL8561208 0.77 HPGD (0.43) MAPTHTTLMNAMAPK1HPGD
SCHEMBL8563024 0.76 KMT2A (0.57) MAPTHTTEGFRLMNAMAPK1
SCHEMBL8564301 0.75 KDM4E (0.47) MAPTHTTLMNAMAPK1HPGD
SCHEMBL4926850 0.75 MAPT (0.66) MAPTHTTLMNAMAPK1HPGD

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