SCHEMBL6233296

SCHEMBL6233296

CC(C)(C)c1c(O)c(OC(=O)O)cc(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.36
POLA1 P09884 1/20 0.36
ANTXR2 P58335 1/20 0.36
MAPT P10636 1/20 0.33
GLRA3 O75311 1/20 0.33
GLRB P48167 1/20 0.33
SERPINE1 P05121 2/20 0.32
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GABBR2 O75899 1/20 0.30
GABBR1 Q9UBS5 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
NFKB1 P19838 1/20 0.30
XDH P47989 1/20 0.30
GFER P55789 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30

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
SCHEMBL5588963 0.83 POLB (0.42) POLBPOLA1ANTXR2MAPTSERPINE1
SCHEMBL6232095 0.79 LMNA (0.33) POLBMAPTTDP1LMNA
SCHEMBL20156673 0.75 CES2 (0.38) POLBPOLA1ANTXR2LMNA
SCHEMBL6257102 0.74 AKR1B1 (0.38) GLRA3GLRBTDP1GABBR2GABBR1
SCHEMBL6232532 0.74 LDHA (0.34) POLBPOLA1ANTXR2PTGS2
SCHEMBL6232547 0.74 AKR1B1 (0.38) GLRA3GLRBGABBR2GABBR1
SCHEMBL15454206 0.74 CES2 (0.34) POLBPOLA1ANTXR2MAPTTDP1
SCHEMBL16239995 0.73 LMNA (0.34) TDP1LMNA
SCHEMBL6234052 0.73 TPMT (0.41) POLBMAPTPTGS2TDP1SMN1; SMN2
SCHEMBL31265639 0.73 ALOX5 (0.31) POLBMAPTNFKB1NFKB2RELA

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
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP claimed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO claimed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed