SCHEMBL8565256

SCHEMBL8565256

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

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TSHR P16473 2/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
GPR35 Q9HC97 1/20 0.36
USP2 O75604 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
CDK2 P24941 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
SCHEMBL8566844 0.87 MEN1 (0.40) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL6733075 0.81 ALDH1A1 (0.43) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL8562112 0.79 GAA (0.41) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL4457346 0.78 MAPT (0.50) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL17555458 0.78 ALDH1A1 (0.36) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL8569930 0.78 MEN1 (0.35) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL16026726 0.78 TSHR (0.44) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL8563757 0.73 ALDH1A1 (0.40) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL8568327 0.73 MEN1 (0.39) ALDH1A1MEN1KMT2AUSP2KEAP1
SCHEMBL8560493 0.73 ALDH1A1 (0.38) MAPTALDH1A1MEN1KMT2APOLB

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