SCHEMBL7860477

SCHEMBL7860477

NN(C(=O)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.58
RAB9A P51151 6/20 0.58
NPC1 O15118 4/20 0.58
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TLR9 Q9NR96 1/20 0.55
PTPN1 P18031 1/20 0.54
P2RX5 Q93086 1/20 0.53
P2RX4 Q99571 1/20 0.53
P2RX7 Q99572 1/20 0.53
P2RX2 Q9UBL9 1/20 0.53
GAA P10253 3/20 0.51
ALDH1A1 P00352 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 1/20 0.51
LMNA P02545 2/20 0.50
SETD7 Q8WTS6 1/20 0.50
POLB P06746 2/20 0.48
MCL1 Q07820 1/20 0.47

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
SCHEMBL7863728 0.81 ALDH1A1 (0.60) MAPTRAB9ANPC1MEN1KMT2A
Hydrochloric Acid SCHEMBL11829820 0.80 ALDH1A1 (0.58) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL4799172 0.79 MAPT (0.49) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL11674649 0.74 CRHBP (0.59) MAPTMEN1KMT2AL3MBTL1TLR9
SCHEMBL11135292 0.74 ALDH1A1 (0.62) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL30448936 0.73 MAPT (0.59) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL141303 0.73 MAPT (0.59) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL16740648 0.72 PTPN1 (0.86) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL16740649 0.72 PTPN1 (0.86) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL8712551 0.72 MAPT (0.72) MAPTRAB9ANPC1MEN1KMT2A

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