SCHEMBL9607095

SCHEMBL9607095

CCCCC/C=C\CCCC/C=C\CC(O)/C=C\C/C=C\CC(O)C/C=C\CCC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 1/20 0.57
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
FAAH O00519 3/20 0.50
ALDH1A1 P00352 5/20 0.49
LTB4R Q15722 1/20 0.49
LTB4R2 Q9NPC1 1/20 0.49
FFAR1 O14842 4/20 0.49
FFAR4 Q5NUL3 2/20 0.49
PPARG P37231 4/20 0.48
PPARD Q03181 3/20 0.48
PPARA Q07869 3/20 0.48
F7 P08709 3/20 0.48
F3 P13726 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP19A1 P11511 2/20 0.48

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
SCHEMBL9607127 0.89 OXER1 (0.68) OXER1NFKB1NFKB2RELAALDH1A1
SCHEMBL9607097 0.83 NFKB1 (0.53) OXER1NFKB1NFKB2RELAFAAH
SCHEMBL9607098 0.83 NFKB1 (0.62) OXER1NFKB1NFKB2RELAFAAH
SCHEMBL26461188 0.82 PPARG (0.67) OXER1ALDH1A1FFAR1FFAR4PPARG
SCHEMBL1925654 0.82 PPARG (0.67) OXER1ALDH1A1FFAR1FFAR4PPARG
SCHEMBL15908481 0.82 PPARG (0.67) OXER1ALDH1A1FFAR1FFAR4PPARG
SCHEMBL13148472 0.81 OXER1 (0.62) OXER1NFKB1NFKB2RELAFAAH
SCHEMBL12261544 0.81 ALDH1A1 (0.68) OXER1ALDH1A1FFAR1FFAR4PPARG
SCHEMBL3405020 0.79 OXER1 (0.82) OXER1NFKB1NFKB2RELAALDH1A1
SCHEMBL9607096 0.78 FFAR1 (0.70) NFKB1NFKB2RELAFAAHALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120136057-A1 HYDROXY FATTY ACID COMPOUNDS AND USES THEREOF FOR DISEASE TREATMENT AND DIAGNOSIS PHENOMENOME DISCOVERIES INC. (CA) 2012-05-31 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-20120136057-A1 HYDROXY FATTY ACID COMPOUNDS AND USES THEREOF FOR DISEASE TREATMENT AND DIAGNOSIS HCAR2, ALOX5, ALOX12 OXER1 152/4885NFKB1 514/4885NFKB2 245/4885

“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.