SCHEMBL7991463

SCHEMBL7991463

CCC(CC)(NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)P(=O)(O)O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
MAPK1 P28482 3/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
APEX1 P27695 1/20 0.57
PLCG2 P16885 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
THRB P10828 1/20 0.53
HRH4 Q9H3N8 1/20 0.50
PYGL P06737 1/20 0.47
PYGM P11217 1/20 0.47
FBP1 P09467 6/20 0.41
XDH P47989 1/20 0.40
NSD2 O96028 1/20 0.38

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
SCHEMBL6215530 0.80 APEX1 (0.70) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL7993493 0.79 PLCG2 (0.67) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL7991465 0.76 PLCG2 (0.60) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL1277489 0.74 APEX1 (0.70) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL1016404 0.74 APEX1 (0.65) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL1277212 0.74 APEX1 (1.00) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL5268675 0.74 APEX1 (1.00) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL1653052 0.73 APEX1 (0.76) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL7991470 0.72 APEX1 (0.53) MAPTMAPK1NPC1RAB9AAPEX1
SCHEMBL2304168 0.72 PLCG2 (1.00) MAPTMAPK1NPC1RAB9AAPEX1

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
US-6294672-B1 FOR THERAPY OF DIABETES, AND OTHER DISEASES WHERE THE INHIBITION OF GLUCONEOGENESIS, CONTROL OF BLOOD GLUCOSE LEVELS, REDUCTION IN GLYCOGEN STORES, OR REDUCTION IN INSULIN LEVELS IS BENEFICIAL METABASIS THERAPEUTICS, INC. 2001-09-25 US disclosed
US-6054587-A ANTIDIABETIC AGENTS METABASIS THERAPEUTICS, INC. (US) 2000-04-25 US disclosed
WO-1998039342-A1 NOVEL INDOLE AND AZAINDOLE INHIBITORS OF FRUCTOSE-1,6-BISPHOSPHATASE METABASIS THERAPEUTICS, INC. (US) 1998-09-11 WO disclosed