SCHEMBL5587405

SCHEMBL5587405

CCCCOc1cc(C(C)C)c(OC(=O)O)c(O)c1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.40
PPARG P37231 4/20 0.40
RARG P13631 1/20 0.40
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39
PPARA Q07869 1/20 0.39
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
RARA P10276 2/20 0.37
RARB P10826 2/20 0.37
RXRB P28702 2/20 0.37
RXRG P48443 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
NPBWR1 P48145 1/20 0.36
MCHR1 Q99705 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.35
ADRA2A P08913 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL5586857 0.94 RXRA (0.39) RXRAPPARGRARGPTGESALOX5
SCHEMBL5588814 0.89 TSHR (0.36) RXRAPPARGRARGTHRATHRB
SCHEMBL5588667 0.81 PKM (0.38) RXRAPPARGRARGTHRATHRB
SCHEMBL5587511 0.81 THRA (0.39) RXRAPPARGPTGESALOX5PPARA
SCHEMBL5587984 0.80 THRA (0.38) RXRAPPARGRARGTHRATHRB
SCHEMBL6235777 0.78 THRA (0.38) RXRAPPARGRARGTHRATHRB
SCHEMBL5587174 0.77 THRA (0.37) THRATHRB
SCHEMBL5587398 0.76 GABRA1 (0.40) THRATHRB
SCHEMBL5588330 0.74 THRA (0.35) THRATHRB
SCHEMBL5586591 0.74 THRA (0.43) THRATHRB

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 3 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

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 RXRA 4204/4885PPARG 3592/4885RARG 4534/4885

“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.