SCHEMBL4579398

SCHEMBL4579398

Fc1ccccc1/C=C/CBr

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 13/20 0.62
RELA Q04206 2/20 0.42
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAOB P27338 1/20 0.40
TRPA1 O75762 1/20 0.39
GRM4 Q14833 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
SCHEMBL9488120 1.00 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL9875741 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL15050711 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL9723366 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL320615 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL24709985 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL4090323 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL14416278 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL7292536 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1
SCHEMBL12426131 0.78 NFE2L2 (0.62) NFE2L2RELANPC1PKMNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963260-A1 PROCESS FOR THE PRODUCTION OF EZETIMIBE AND INTERMEDIATES USED IN THIS PROCES Richter Gedeon NYRT (HU) 2008-09-03 EP disclosed
WO-2007072088-A1 PROCESS FOR THE PRODUCTION OF EZETIMIBE AND INTERMEDIATES USED IN THIS PROCES RICHTER GEDEON NYRT. (HU) 2007-06-28 WO disclosed
EP-0143952-B1 SUBSTITUTED CINNAMYL-2,3-DIHYDROBENZOPYRANS AND CINNAMYLPHENOLS USEFUL AS ANTI-INFLAMMATORY AGENTS MERCK & CO. INC. (US) 1993-01-13 EP disclosed
US-4778818-A VISION AND SKIN DISORDERS MERCK & CO., INC. (US) 1988-10-18 US disclosed
US-4686235-A TOPICAL MERCK & CO., INC. (US) 1987-08-11 US disclosed
US-4537903-A Substituted cinnamyl-2,3-dihydrobenzofuran and analogs useful as anti-inflammatory agents MERCK & CO., INC. (US) 1985-08-27 US disclosed
EP-0143952-A1 Substituted cinnamyl-2,3-dihydrobenzopyrans and cinnamylphenols useful as anti-inflammatory agents MERCK & CO. INC. (US) 1985-06-12 EP disclosed