SCHEMBL8570526

SCHEMBL8570526

Nc1nccc(C=Cc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.43
NFE2L2 Q16236 1/20 0.43
MAPT P10636 4/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
GRM4 Q14833 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
FBP1 P09467 1/20 0.41
HTT P42858 3/20 0.40
KDM4E B2RXH2 1/20 0.40
MITF O75030 1/20 0.40
NOD2 Q9HC29 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALK Q9UM73 1/20 0.40
ALDH1A1 P00352 1/20 0.40
DHFR P00374 1/20 0.38

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
SCHEMBL5036514 0.86 MAPT (0.45) NFE2L2MAPTLMNASMN1; SMN2MEN1
SCHEMBL5036513 0.86 MAPT (0.45) NFE2L2MAPTLMNASMN1; SMN2MEN1
SCHEMBL5033930 0.84 MAPT (0.48) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL5033933 0.84 MAPT (0.48) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL8566303 0.80 MAPT (0.40) NFE2L2MAPTLMNASMN1; SMN2MEN1
SCHEMBL8566306 0.80 MAPT (0.40) NFE2L2MAPTLMNASMN1; SMN2MEN1
SCHEMBL8564865 0.79 ALK (0.46) TAAR1NFE2L2MAPTMEN1POLB
SCHEMBL9995198 0.78 MAPT (0.43) NFE2L2MAPTLMNASMN1; SMN2MEN1
SCHEMBL8855377 0.77 NFE2L2 (0.50) TAAR1NFE2L2MAPTMEN1POLB
SCHEMBL8565832 0.77 TAAR1 (0.50) TAAR1NFE2L2MAPTLMNASMN1; SMN2

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