SCHEMBL13169166

SCHEMBL13169166

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(CC)COC(=O)CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
CYP19A1 P11511 4/20 0.46
OXER1 Q8TDS5 4/20 0.46
PPARG P37231 3/20 0.46
MAPT P10636 3/20 0.46
RXRA P19793 2/20 0.46
FFAR1 O14842 2/20 0.46
PTGS1 P23219 4/20 0.44
F7 P08709 3/20 0.44
F3 P13726 3/20 0.44
ADORA3 P0DMS8 2/20 0.44
KMT2A Q03164 2/20 0.44
PPARD Q03181 2/20 0.44
PPARA Q07869 2/20 0.44
NR1I2 O75469 2/20 0.43
PTGS2 P35354 2/20 0.43
PGR P06401 1/20 0.43
PDE4D Q08499 1/20 0.43
CYP3A4 P08684 3/20 0.42
TDP1 Q9NUW8 3/20 0.42

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
SCHEMBL13169080 0.89 ADORA3 (0.43) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL13169167 0.86 ALDH1A1 (0.51) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL14036955 0.82 ADORA3 (0.47) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL13169168 0.82 ALDH1A1 (0.56) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL3688839 0.80 ADORA3 (0.38) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL13609252 0.79 TSHR (0.55) ALDH1A1MAPTKMT2ACYP3A4TDP1
SCHEMBL3691603 0.77 PRKCA (0.38) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL14036961 0.75 ADORA3 (0.35) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL3695677 0.74 ADORA3 (0.34) ALDH1A1CYP19A1OXER1PPARGMAPT
SCHEMBL4557650 0.73 ATM (0.40) ALDH1A1ADORA3NR1I2PTGS2PGR

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-20100240616-A1 NOVEL LIPID COMPOUNDS PRONOVA BIOPHARMA NORGE AS (NO) 2010-09-23 US disclosed
US-20100240616-A1 NOVEL LIPID COMPOUNDS PRONOVA BIOPHARMA NORGE AS (NO) 2010-09-23 US disclosed
WO-2008132552-A2 OMEGA-3 LIPID COMPOUNDS PRONOVA BIOPHARMA NORGE AS (US) 2008-11-06 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-20100240616-A1 NOVEL LIPID COMPOUNDS ELOVL3, FFAR3, STARD3 ALDH1A1 2317/4885CYP19A1 1573/4885OXER1 549/4885

“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.