SCHEMBL8563396

SCHEMBL8563396

Nc1c(C(=O)Cc2ccccc2)ccnc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ASPH Q12797 1/20 0.38
KDM8 Q8N371 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 7/20 0.37
MAPT P10636 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
HTT P42858 2/20 0.37
POLB P06746 1/20 0.37
ESR2 Q92731 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
MITF O75030 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL8564375 0.82 KMT2A (0.46) CES2CES1KDM4EKMT2AMEN1
SCHEMBL8562600 0.81 LMNA (0.47) CES2CES1KDM4EKMT2AALDH1A1
SCHEMBL8560654 0.81 RAB9A (0.52) KMT2AMEN1ALDH1A1MAPTL3MBTL1
SCHEMBL8561698 0.81 NSD2 (0.50) KMT2AMEN1L3MBTL1HTTSMN1; SMN2
SCHEMBL8560442 0.79 KDM4E (0.45) KDM4EASPHKDM8KMT2AMEN1
SCHEMBL8559950 0.77 ALDH1A1 (0.39) CES2CES1KMT2AMEN1ALDH1A1
SCHEMBL8566712 0.77 CYP19A1 (0.43) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL8567497 0.76 ALDH1A1 (0.42) KDM4EASPHKDM8KMT2AMEN1
SCHEMBL8563829 0.75 MAPK1 (0.37) KDM4EASPHKDM8KMT2AALDH1A1
SCHEMBL8564862 0.75 KDM4E (0.37) CES2CES1KDM4EASPHKDM8

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