SCHEMBL5589694

SCHEMBL5589694

CCCOc1c(C)c(OC(=O)O)c(O)c(OCCC)c1OCCC

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSTA1 P08263 2/20 0.32
GSTP1 P09211 2/20 0.32
TSHR P16473 1/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CREB1 P16220 1/20 0.31
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MEN1 O00255 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
SCHEMBL5588277 0.95 GSTA1 (0.32) GSTA1GSTP1KMT2ALMNAL3MBTL1
SCHEMBL5587547 0.92 GSTA1 (0.32) GSTA1GSTP1TSHRKMT2ALMNA
SCHEMBL5589972 0.90 THRA (0.40) GSTA1GSTP1TSHRKMT2ALMNA
SCHEMBL5589546 0.89 THRA (0.41) TSHR
SCHEMBL5589373 0.88 THRA (0.43) TSHRKMT2AMEN1
SCHEMBL5589573 0.88 THRA (0.43) TSHRKMT2AMEN1
SCHEMBL5587027 0.88 THRA (0.43) TSHRKMT2AMEN1
SCHEMBL5586806 0.88 THRA (0.43) TSHRKMT2AMEN1
SCHEMBL5589006 0.86 THRB (0.33) TSHRL3MBTL1ALDH1A1
SCHEMBL5589793 0.84 THRA (0.42) TSHRKMT2AMEN1

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 GSTA1 2067/4885GSTP1 2956/4885TSHR 4680/4885

“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.