SCHEMBL8600968

SCHEMBL8600968

CCCCCNC(=O)c1ncccc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
NAAA Q02083 3/20 0.47
LMNA P02545 3/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HPGD P15428 1/20 0.47
ATM Q13315 1/20 0.47
POLB P06746 1/20 0.46
ALOX12 P18054 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 3/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MGLL Q99685 1/20 0.43
ASAH1 Q13510 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
SCHEMBL11723480 0.85 ALDH1A1 (0.48) KMT2ALMNAMEN1ALDH1A1HTT
SCHEMBL8600883 0.80 LMNA (0.46) KMT2ALMNAMEN1KDM4EALDH1A1
SCHEMBL1423557 0.80 EGLN2 (0.60) NAAAHPGDALOX12KDM4EHTT
SCHEMBL31500526 0.80 NAAA (0.52) NAAALMNAHPGDALOX12KDM4E
SCHEMBL8597516 0.80 HTT (0.52) NAAALMNAHPGDALOX12KDM4E
SCHEMBL8778065 0.79 LMNA (0.52) KMT2ALMNAMEN1TP53HSP90AA1
SCHEMBL1423213 0.79 NAAA (0.51) NAAAHPGDALOX12KDM4EHTT
SCHEMBL14284344 0.79 NAAA (0.61) NAAAHPGDALOX12KDM4EHTT
SCHEMBL9626697 0.79 NAAA (0.61) NAAAHPGDALOX12KDM4EHTT
SCHEMBL9967355 0.79 NAAA (0.55) NAAALMNAHPGDALOX12KDM4E

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