SCHEMBL7988937

SCHEMBL7988937

O=COc1c(O)c2ccc([N+](=O)[O-])cc2[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.55
GRIA1 P42261 1/20 0.49
GRIA2 P42262 1/20 0.49
GRIA3 P42263 1/20 0.49
GRIA4 P48058 1/20 0.49
DAO P14920 1/20 0.47
GRIN2D O15399 3/20 0.46
GRIN3B O60391 3/20 0.46
GRIN1 Q05586 3/20 0.46
GRIN2A Q12879 3/20 0.46
GRIN2B Q13224 3/20 0.46
GRIN2C Q14957 3/20 0.46
GRIN3A Q8TCU5 3/20 0.46
FASN P49327 1/20 0.45
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
CDK5 Q00535 1/20 0.39

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
SCHEMBL8000790 0.84 PARP1 (0.57) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8001042 0.84 PARP1 (0.53) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7997490 0.81 PARP1 (0.53) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7997773 0.81 PARP1 (0.53) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8001551 0.81 PARP1 (0.50) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8000855 0.81 PARP1 (0.67) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7988730 0.79 PARP1 (0.45) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7988724 0.79 PARP1 (0.45) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8000636 0.78 PARP1 (0.50) PARP1GRIA1GRIA2GRIA3GRIA4
SCHEMBL8004808 0.78 PARP1 (0.47) PARP1GRIA1GRIA2GRIA3GRIA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6001373-A WATER-IN-OIL OR OIL-IN-WATER EMULSION COMPRISING SILICONE OIL SELECTED FROM VOLATILE AND NON-VOLATILE SILICONES, HUMECTANTS, PIGMENTS THE PROCTER & GAMBLE COMPANY (US) 1999-12-14 US claimed
WO-1995009598-A1 COSMETIC MAKE-UP COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1995-04-13 WO claimed
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
EP-0768861-A4 COSMETIC COMPOSITIONS AND PROCESSES FOR MANUFACTURE THEREOF PROCTER & GAMBLE (US) 2000-02-23 EP disclosed
US-6001373-A WATER-IN-OIL OR OIL-IN-WATER EMULSION COMPRISING SILICONE OIL SELECTED FROM VOLATILE AND NON-VOLATILE SILICONES, HUMECTANTS, PIGMENTS THE PROCTER & GAMBLE COMPANY (US) 1999-12-14 US disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
US-5853712-A Cosmetic compositions containing water dispersible pigment which is surface treated with a polymer and process THE PROCTER & GAMBLE COMPANY (US) 1998-12-29 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed
EP-0768861-A1 COSMETIC COMPOSITIONS AND PROCESSES FOR MANUFACTURE THEREOF THE PROCTER & GAMBLE COMPANY (US) 1997-04-23 EP disclosed
WO-1996003964-A1 COSMETIC COMPOSITIONS AND PROCESSES FOR MANUFACTURE THEREOF THE PROCTER & GAMBLE COMPANY (US) 1996-02-15 WO disclosed
WO-1995009598-A1 COSMETIC MAKE-UP COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1995-04-13 WO disclosed