SCHEMBL8562265

SCHEMBL8562265

Nc1nc2ccccc2c(Cc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
MGMT P16455 1/20 0.48
LMNA P02545 4/20 0.47
HPGD P15428 1/20 0.47
TLR8 Q9NR97 4/20 0.44
MAPK1 P28482 2/20 0.44
HTT P42858 2/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KMT2A Q03164 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
SCHEMBL8566816 0.84 MAPT (0.43) MAPTMGMTLMNAHPGDTLR8
SCHEMBL27196616 0.81 MAPT (0.49) MAPTMGMTLMNAHPGDMAPK1
SCHEMBL8559235 0.81 KDM4E (0.41) MAPTLMNAHPGDTLR8MAPK1
SCHEMBL8599452 0.81 MAPT (0.43) MAPTMGMTLMNAHPGDTLR8
SCHEMBL15147641 0.80 TLR8 (0.51) MAPTLMNAHPGDTLR8HTT
SCHEMBL8567950 0.80 CYP3A4 (0.47) MAPTMGMTLMNAHPGDMAPK1
SCHEMBL8564398 0.79 POLB (0.43) MAPTMGMTLMNAHPGDTLR8
SCHEMBL27842115 0.79 TLR8 (0.45) MAPTMGMTLMNATLR8HTT
SCHEMBL8596689 0.79 TLR8 (0.61) MAPTLMNAHPGDTLR8ALDH1A1
SCHEMBL3953291 0.79 KDM4E (0.52) MAPTMGMTLMNAHPGDMAPK1

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