SCHEMBL7982785

SCHEMBL7982785

COc1ccc(/C=C/c2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 3/20 0.59
TLR9 Q9NR96 1/20 0.58
PTGS2 P35354 6/20 0.56
PTGS1 P23219 2/20 0.56
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
SNCA P37840 1/20 0.48
CYP19A1 P11511 1/20 0.48
FBP1 P09467 1/20 0.47
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP1B1 Q16678 1/20 0.46
MAPT P10636 2/20 0.45
APP P05067 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL7982786 1.00 NFE2L2 (0.59) NFE2L2TLR9PTGS2PTGS1MAOA
SCHEMBL567173 0.82 NFE2L2 (0.64) NFE2L2TLR9PTGS2PTGS1MAOA
SCHEMBL567172 0.82 NFE2L2 (0.64) NFE2L2TLR9PTGS2PTGS1MAOA
SCHEMBL1005735 0.79 PTGS2 (0.78) NFE2L2TLR9PTGS2PTGS1MAOA
SCHEMBL1005734 0.79 PTGS2 (0.78) NFE2L2TLR9PTGS2PTGS1MAOA
SCHEMBL6721800 0.76 TLR9 (0.71) NFE2L2TLR9PTGS2PTGS1MAOA
SCHEMBL9826746 0.76 TLR9 (0.80) NFE2L2TLR9PTGS2PTGS1CYP19A1
SCHEMBL9826744 0.76 TLR9 (0.80) NFE2L2TLR9PTGS2PTGS1CYP19A1
SCHEMBL13549964 0.76 AKR1C3 (0.54) NFE2L2MAPTAPPNPC1RAB9A
SCHEMBL227066 0.74 TLR9 (0.60) NFE2L2TLR9PTGS2PTGS1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5361148-A Apparatus for photorefractive two beam coupling INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1994-11-01 US claimed
US-6280884-B1 HOLOGRAPHIC STORAGE IN PHOTOREFRACTIVE POLYMERIC OPTICAL ARTICLE, EXPOSURE TO ELECTROMAGNETIC RADIATION WITH INTERSECTING BEAMS INTERNATIONAL BUSINESS MACHINES CORPORATION 2001-08-28 US disclosed
US-5759725-A Photoconductors and electrophotographic photoreceptors containing amorphous fullerenes KABUSHIKI KAISHA TOSHIBA (JP) 1998-06-02 US disclosed
US-5719690-A Photorefractive glass article INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1998-02-17 US disclosed
US-5361148-A Apparatus for photorefractive two beam coupling INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1994-11-01 US disclosed