SCHEMBL5589217

SCHEMBL5589217

CCOc1c(C)c(O)c(O)c(C)c1OCC

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GAA P10253 2/20 0.33
LTA4H P09960 1/20 0.33
TSHR P16473 1/20 0.33
NQO1 P15559 1/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
THRB P10828 1/20 0.31
ESR1 P03372 1/20 0.31
ADRA2A P08913 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
SCHEMBL5588997 0.93 KDM4E (0.31) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL5587348 0.87 KDM4E (0.31) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL5590551 0.82 KDM4E (0.31) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL25326777 0.81 KDM4E (0.33) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL5587068 0.79 LTA4H (0.38) ALDH1A1GAALTA4HMAPT
SCHEMBL25329867 0.77 CYP1A2 (0.37) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL5589219 0.77 THRB (0.34) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL16575414 0.76 NQO1 (0.40) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL5586804 0.75 LTA4H (0.44) LTA4HTSHRTHRBESR1
SCHEMBL9658493 0.74 ALDH1A1 (0.41) KDM4EALDH1A1HPGDHSD17B10GAA

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-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 KDM4E 1868/4885ALDH1A1 2181/4885HPGD 2689/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.