SCHEMBL7860474

SCHEMBL7860474

O=[N+]([O-])c1ccc(NN=Cc2ccc3c(c2)OCO3)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.69
KMT2A Q03164 10/20 0.69
MAPT P10636 13/20 0.65
RAB9A P51151 7/20 0.65
NPC1 O15118 5/20 0.65
L3MBTL1 Q9Y468 3/20 0.65
LMNA P02545 2/20 0.65
GAA P10253 1/20 0.65
PAX8 Q06710 1/20 0.65
SMN1; SMN2 Q16637 3/20 0.64
HTT P42858 2/20 0.64
MAPK1 P28482 2/20 0.64
ALDH1A1 P00352 5/20 0.62
CYP1A2 P05177 2/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
KDM4E B2RXH2 4/20 0.58
TLR9 Q9NR96 2/20 0.58

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
SCHEMBL7863725 0.80 RAB9A (0.71) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL19097687 0.78 PTPN1 (0.71) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL11429130 0.77 GAA (0.65) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL1132698 0.76 MEN1 (0.75) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL1132701 0.76 MEN1 (0.75) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL11421698 0.74 MAPT (0.65) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL10421074 0.74 MEN1 (0.61) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL12218394 0.74 KMT2A (0.73) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL19244893 0.74 MEN1 (0.73) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL28072285 0.74 MEN1 (0.73) MEN1KMT2AMAPTRAB9ANPC1

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-0729139-B1 Optical recording medium using formazan metal complex dye TDK CORP (JP) 2001-02-07 EP disclosed
US-5604004-A Optical recording medium using formazan metal complex dye and photo-stabilizing method TDK CORPORATION (JP) 1997-02-18 US disclosed
EP-0729139-A1 Optical recording medium using formazan metal complex dye and photo-stabilizing method TDK Corporation (JP) 1996-08-28 EP disclosed