SCHEMBL5586660

SCHEMBL5586660

CCCCc1c(O)c(OC(=O)O)c(F)c(CCCC)c1CCCC

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.36
FFAR1 O14842 1/20 0.36
HCAR2 Q8TDS4 2/20 0.35
HCAR3 P49019 1/20 0.33
HPGD P15428 3/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALOX5 P09917 4/20 0.31
KDM4E B2RXH2 2/20 0.30
PKM P14618 1/20 0.30
ALDH1A1 P00352 2/20 0.30
HSD17B10 Q99714 2/20 0.30
AKR1C2 P52895 1/20 0.30
AKR1C1 Q04828 1/20 0.30
LMNA P02545 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
SCHEMBL5589151 0.95 ESR1 (0.36) ESR1FFAR1HCAR2HCAR3HPGD
SCHEMBL5587847 0.94 ALOX5 (0.38) ESR1HCAR2HCAR3ALOX5ALDH1A1
SCHEMBL5588192 0.94 ALOX5 (0.38) ESR1HCAR2HCAR3ALOX5ALDH1A1
SCHEMBL5588412 0.94 ALOX5 (0.38) ESR1HCAR2HCAR3ALOX5ALDH1A1
SCHEMBL5586726 0.94 ALOX5 (0.38) ESR1HCAR2HCAR3ALOX5ALDH1A1
SCHEMBL5589087 0.94 ESR1 (0.36) ESR1FFAR1HCAR2HCAR3HPGD
SCHEMBL5588166 0.90 LDHA (0.33) ESR1
SCHEMBL5588382 0.89 ESR1 (0.36) ESR1FFAR1HCAR2HCAR3HPGD
SCHEMBL5588570 0.88 ALOX5 (0.38) ESR1HCAR2HCAR3ALOX5ALDH1A1
SCHEMBL5587801 0.88 ALOX5 (0.38) ESR1HCAR2HCAR3ALOX5ALDH1A1

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 ESR1 1108/4885FFAR1 2521/4885HCAR2 3141/4885

“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.