SCHEMBL1653137

SCHEMBL1653137

O=c1c(=O)n([N+](=O)[O-])c2ccccc2n1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
ALDH1A1 P00352 6/20 0.40
LMNA P02545 5/20 0.40
NPSR1 Q6W5P4 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TLR9 Q9NR96 2/20 0.40
XBP1 P17861 1/20 0.40
PAX8 Q06710 1/20 0.40
KDM4E B2RXH2 2/20 0.39
HSD17B10 Q99714 1/20 0.37
MITF O75030 1/20 0.37
AGTR1 P30556 1/20 0.37
HTT P42858 1/20 0.37
HSPD1 P10809 1/20 0.36
HSPE1 P61604 1/20 0.36
P2RX4 Q99571 1/20 0.35
XDH P47989 1/20 0.35
MEN1 O00255 3/20 0.35

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
SCHEMBL7345710 0.77 PARP1 (0.46) MAPTALDH1A1NPSR1KDM4EMEN1
SCHEMBL3557147 0.76 MAPT (0.46) MAPTALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL1051084 0.73 CA12 (0.50) MAPTALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL1134767 0.71 MAPK1 (0.50) ALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL11876810 0.69 HSD17B10 (0.38) MAPTALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL31326012 0.67 ALDH1A1 (0.41) MAPTALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL8015679 0.64 MAPT (0.31) MAPTALDH1A1NPSR1HTTMEN1
SCHEMBL4080987 0.64 CDK4 (0.43) ALDH1A1LMNARAB9AHTTMEN1
SCHEMBL30522768 0.64 CDK4 (0.43) ALDH1A1LMNARAB9AHTTMEN1
SCHEMBL891427 0.62 SCN2A (0.50) ALDH1A1SMN1; SMN2KDM4EHSD17B10HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150184184-A1 GLUTAMATE RECEPTORS IN NUTRIENT SENSING, METABOLISM, GROWTH AND DEVELOPMENT BALASUBRAMANIAN, SIVASUBRAMANIAN (IN) 2015-07-02 US disclosed
US-8889950-B2 Repression of AtGLR3.2 increases plant biomass THE GEORGE WASHINGTON UNIVERSITY (US) 2014-11-18 US disclosed
WO-2011049560-A1 GLUTAMATE RECEPTORS IN NUTRIENT SENSING, METABOLISM, GROWTH AND DEVELOPMENT THE GEORGE WASHINGTON UNIVERSITY (US) 2011-04-28 WO disclosed
US-20090265805-A1 Glutamate receptors in nutrient sensing, metabolism, Growth and Development BALASUBRAMANIAN, SIVASUBRAMANIAN (IN) 2009-10-22 US disclosed