SCHEMBL5588409

SCHEMBL5588409

CCCCOc1c(OCCCC)c(C(C)C)c(O)c(O)c1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.40
NR5A1 Q13285 1/20 0.40
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
ESR1 P03372 3/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
PLA2G4B P0C869 1/20 0.35
TLR4 O00206 1/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL5590500 0.88 LTA4H (0.34) LTA4HTLR4
SCHEMBL5587984 0.82 THRA (0.38) THRATHRBESR1TP53TSHR
SCHEMBL6235771 0.81 ESR1 (0.40) LTA4HNR5A1THRATHRBESR1
SCHEMBL9945971 0.79 ESR1 (0.37) LTA4HNR5A1THRATHRBESR1
SCHEMBL5586599 0.79 MAPT (0.32) LTA4HTSHRHPGDL3MBTL1
SCHEMBL6235777 0.75 THRA (0.38) THRATHRBESR1TP53
SCHEMBL5589050 0.73 LTA4H (0.38) LTA4HNR5A1THRATHRBESR1
SCHEMBL5586804 0.72 LTA4H (0.44) LTA4HNR5A1THRATHRBESR1
SCHEMBL10692851 0.72 LTA4H (0.46) LTA4HNR5A1THRATHRBTSHR
SCHEMBL6233828 0.72 BCL2 (0.35) ESR1TP53HPGDSMN1; SMN2

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 LTA4H 147/4885NR5A1 2413/4885THRA 3787/4885

“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.