SCHEMBL8567927

SCHEMBL8567927

Nc1cncc(C2CCNCC2)c1[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
PLAT P00750 1/20 0.34
PARP1 P09874 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HTR2C P28335 3/20 0.32
MAPT P10636 2/20 0.32
THRB P10828 1/20 0.32
GABRA1 P14867 5/20 0.32
GABRB2 P47870 3/20 0.32
CDK2 P24941 1/20 0.32
RECQL P46063 1/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
RPS6KA3 P51812 1/20 0.31
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31

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
SCHEMBL8566844 0.73 MEN1 (0.40) MAPTTLR9
SCHEMBL8562692 0.72 HTT (0.40) PIM1PIM3PIM2HRH3HTR2C
SCHEMBL8560822 0.72 MEN1 (0.43) HRH3HTR2CMAPTGABRA1GABRG2
SCHEMBL3536567 0.71 HTR2C (0.50) HTR2CGABRA1GABRG2GABRB3
SCHEMBL8564380 0.70 MAPT (0.36) PIM1PIM3PIM2PLATHRH4
SCHEMBL8567277 0.70 HTR6 (0.35) PIM1PIM3PIM2HRH3PLAT
SCHEMBL8563511 0.70 MKNK1 (0.36) PIM1PIM3PIM2HRH3PLAT
SCHEMBL31319374 0.67 CDK2 (0.40) MAPTCDK2
SCHEMBL8562626 0.67 HTR6 (0.36) HRH3HTR2CRPS6KA3
SCHEMBL6672459 0.67 MAPT (0.47) HTR2CMAPTRECQL

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