SCHEMBL8561895

SCHEMBL8561895

Nc1nccc(S(=O)(=O)NCc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.52
CYP19A1 P11511 1/20 0.48
POLB P06746 1/20 0.48
KEAP1 Q14145 1/20 0.47
LMNA P02545 4/20 0.46
MAPT P10636 2/20 0.46
NSD2 O96028 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 1/20 0.46
CA13 Q8N1Q1 1/20 0.46
VCAM1 P19320 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SLC12A2 P55011 1/20 0.44
SLC12A5 Q9H2X9 1/20 0.44
CA12 O43570 2/20 0.44
CA9 Q16790 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL8563864 0.82 NSD2 (0.49) CYP19A1POLBKEAP1LMNANSD2
SCHEMBL8566342 0.81 ALDH1A1 (0.48) HTTPOLBLMNAMAPTCA1
SCHEMBL8567834 0.80 POLB (0.48) HTTCYP19A1POLBKEAP1LMNA
SCHEMBL8601525 0.79 KMT2A (0.36) HTTLMNAMAPTCA1CA2
SCHEMBL8567103 0.79 MGMT (0.50) HTTCYP19A1LMNAMAPTCA1
SCHEMBL8566052 0.78 NSD2 (0.49) HTTCYP19A1POLBKEAP1LMNA
SCHEMBL8598219 0.77 RECQL (0.43) HTTPOLBLMNACA1CA2
SCHEMBL8921373 0.76 HTT (0.64) HTTPOLBLMNAMAPTCA1
SCHEMBL8563598 0.75 LMNA (0.55) CYP19A1POLBKEAP1LMNANSD2
SCHEMBL11497750 0.75 CYP19A1 (0.58) CYP19A1POLBKEAP1LMNANSD2

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