SCHEMBL5586771

SCHEMBL5586771

CCCCOOc1cc(C(C)(C)C)c(OC(=O)O)c(O)c1C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 9/20 0.37
GAA P10253 1/20 0.35
XBP1 P17861 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NR5A2 O00482 1/20 0.34
NR5A1 Q13285 1/20 0.34
RXRA P19793 1/20 0.34
PPARG P37231 1/20 0.34

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
SCHEMBL5587149 0.89 VCAM1 (0.39) VCAM1GAAXBP1ATMNPSR1
SCHEMBL5586766 0.85 NR5A2 (0.35) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL5590050 0.83 PTGS1 (0.40) VCAM1RXRAPPARG
SCHEMBL6253644 0.80 GAA (0.33) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL5590041 0.80 VCAM1 (0.40) VCAM1
SCHEMBL5587537 0.78 LMNA (0.44) VCAM1
SCHEMBL5587448 0.74 THRA (0.38) RXRAPPARG
SCHEMBL5587145 0.72 PTGS1 (0.40) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL5589695 0.71 GLRA3 (0.42) VCAM1GAA
SCHEMBL5588061 0.71 GLRA3 (0.42) VCAM1GAA

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
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US 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 VCAM1 985/4885GAA 1882/4885XBP1 2617/4885

“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.