SCHEMBL6474040

SCHEMBL6474040

CN(N)c1ccc([N+](=O)[O-])c2onnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 5/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPK1 P28482 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
HCAR3 P49019 1/20 0.33
NSD2 O96028 1/20 0.32
NCOA1 Q15788 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
GSTP1 P09211 2/20 0.31
GSTM2 P28161 2/20 0.31
POLB P06746 2/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
ALDH3A1 P30838 1/20 0.30
TP53 P04637 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL28078442 0.77 MAPT (0.41) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL1484117 0.75 MEN1 (0.66) MEN1KMT2AMAPTL3MBTL1HTT
SCHEMBL17209987 0.74 PARP1 (0.35) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL31658972 0.74 GSTP1 (0.46) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL3203718 0.74 TDP1 (0.41) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL2313725 0.74 TDP1 (0.46) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL1099537 0.73 MAPT (0.50) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL30665014 0.72 ALDH1A1 (0.38) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL29118433 0.72 ALDH1A1 (0.38) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL6685709 0.71 IDO1 (0.36) MEN1KMT2AMAPTALDH1A1L3MBTL1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6872573-B2 Fluorescent creatinine assay BAYER CORPORATION (US) 2005-03-29 US claimed
WO-2004060832-A2 FLUORESCENT CREATININE ASSAY BAYER HEALTHCARE LLC (US) 2004-07-22 WO claimed
US-20040132200-A1 Fluorescent creatinine assay SIEMENS HEALTHCARE DIAGNOSTICS INC. 2004-07-08 US claimed
US-6872573-B2 Fluorescent creatinine assay BAYER CORPORATION (US) 2005-03-29 US disclosed
US-6872573-B2 Fluorescent creatinine assay BAYER CORPORATION (US) 2005-03-29 US disclosed
WO-2004060832-B1 FLUORESCENT CREATININE ASSAY BAYER HEALTHCARE LLC (US) 2004-12-16 WO disclosed
WO-2004060832-A3 FLUORESCENT CREATININE ASSAY BAYER HEALTHCARE LLC (US) 2004-10-28 WO disclosed
WO-2004060832-A2 FLUORESCENT CREATININE ASSAY BAYER HEALTHCARE LLC (US) 2004-07-22 WO disclosed
WO-2004060832-A2 FLUORESCENT CREATININE ASSAY BAYER HEALTHCARE LLC (US) 2004-07-22 WO disclosed
US-20040132200-A1 Fluorescent creatinine assay SIEMENS HEALTHCARE DIAGNOSTICS INC. 2004-07-08 US disclosed
US-20040132200-A1 Fluorescent creatinine assay SIEMENS HEALTHCARE DIAGNOSTICS INC. 2004-07-08 US disclosed