SCHEMBL8628610

SCHEMBL8628610

C=CCOS(=O)(=O)c1c([N+](=O)[O-])cnc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HTT P42858 2/20 0.36
CYP1A2 P05177 1/20 0.35
TSHR P16473 1/20 0.35
PIN1 Q13526 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDR P35968 1/20 0.34
ATM Q13315 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
LMNA P02545 1/20 0.33
ERN1 O75460 1/20 0.33
NPY1R P25929 1/20 0.32
NPY5R Q15761 1/20 0.32

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
SCHEMBL8562983 0.82 PIN1 (0.48) POLBSMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL8598588 0.81 POLB (0.40) POLBSMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL8627624 0.79 MAPT (0.39) POLBSMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL8599584 0.79 MEN1 (0.39) POLBSMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL8596309 0.79 MEN1 (0.38) POLBSMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL8624593 0.77 MAPT (0.35) POLBSMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL8925738 0.77 GSK3A (0.39) POLBSMN1; SMN2MAPTMEN1KMT2A
SCHEMBL8628924 0.76 PIM1 (0.37) POLBSMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL8560319 0.75 POLB (0.46) POLBSMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL8562402 0.75 POLB (0.46) POLBSMN1; SMN2ALDH1A1MAPTNPC1

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