SCHEMBL5589600

SCHEMBL5589600

CCCCc1c(CCCC)c(OC(=O)O)c(O)c(-c2ccccc2)c1CCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.44
PDE4B Q07343 3/20 0.44
PDE4C Q08493 3/20 0.44
PDE4D Q08499 3/20 0.44
CNR2 P34972 1/20 0.40
GCGR P47871 2/20 0.39
ALDH1A1 P00352 3/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
KDM4E B2RXH2 3/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 1/20 0.37
PREP P48147 1/20 0.37
CELA1 Q9UNI1 1/20 0.37
DCTPP1 Q9H773 1/20 0.37
MAPT P10636 2/20 0.36
NCEH1 Q6PIU2 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL5587539 0.92 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL5586623 0.81 FFAR1 (0.39) ALDH1A1ESR1KDM4EHPGDHSD17B10
SCHEMBL5588923 0.80 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL5589592 0.79 GCGR (0.46) CNR2GCGRALDH1A1KDM4EHPGD
SCHEMBL5588367 0.78 FFAR1 (0.37) ALDH1A1ESR1KDM4EHPGDHSD17B10
SCHEMBL5589825 0.78 CNR2 (0.41) CNR2GCGRALDH1A1ESR1ESR2
SCHEMBL5589039 0.77 FFAR1 (0.36) ALDH1A1ESR1KDM4EHPGDHSD17B10
SCHEMBL5588945 0.76 ALOX5 (0.39) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL27876741 0.75 GCGR (0.49) CNR2GCGRALDH1A1KDM4EHSD17B10
SCHEMBL1962597 0.75 CNR2 (0.52) PDE4DCNR2ALDH1A1ESR1KDM4E

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 PDE4A 4875/4885PDE4B 4878/4885PDE4C 4881/4885

“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.