SCHEMBL8565663

SCHEMBL8565663

Nc1cc(C(=O)NCc2ccccc2)c([N+](=O)[O-])cn1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C19 P33261 2/20 0.58
HTT P42858 2/20 0.54
GAA P10253 1/20 0.53
POLB P06746 1/20 0.52
SIRT6 Q8N6T7 1/20 0.52
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CYP2C9 P11712 1/20 0.47
NAMPT P43490 1/20 0.47
NSD2 O96028 2/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL8567165 0.81 PIN1 (0.40) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL8566566 0.78 CYP1A2 (0.52) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL8560325 0.78 RAB9A (0.51) HTTPOLBKMT2A
SCHEMBL8597304 0.78 ALOX15 (0.43) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL19246188 0.77 KMT2A (0.75) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL30236290 0.77 KMT2A (0.75) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL8560894 0.77 HTR6 (0.55) CYP1A2CYP3A4CYP2C19HTTPOLB
SCHEMBL8567201 0.77 HTT (0.73) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL9646491 0.77 POLB (0.64) HPGDCYP1A2CYP3A4CYP2C19HTT
SCHEMBL21296309 0.76 HPGD (0.63) HPGDCYP1A2CYP3A4CYP2C19HTT

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