SCHEMBL7189716

SCHEMBL7189716

CCc1ccc(OC(CC)CC)c(CCC(=O)c2cc(OC(CC)CC)cc(OC(CC)CC)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.42
PPARD Q03181 10/20 0.42
PPARA Q07869 9/20 0.42
AKT1 P31749 1/20 0.37
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
ACHE P22303 1/20 0.33

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
SCHEMBL7192501 0.93 PPARG (0.44) PPARGPPARDPPARAAKT1LTB4R
SCHEMBL7198537 0.91 PPARG (0.45) PPARGPPARDPPARAPDE4APDE4B
SCHEMBL7196664 0.86 PPARG (0.46) PPARGPPARDPPARAAKT1
SCHEMBL7193908 0.84 PPARG (0.40) PPARGPPARDPPARAAKT1
SCHEMBL7191811 0.83 PPARG (0.43) PPARGPPARDPPARAAKT1LTB4R
SCHEMBL7198834 0.83 PPARG (0.46) PPARGPPARDPPARA
SCHEMBL7194149 0.82 PPARG (0.47) PPARGPPARDPPARA
SCHEMBL7198516 0.81 POLB (0.46) ACHE
SCHEMBL7193285 0.81 PPARG (0.45) PPARGPPARDPPARA
SCHEMBL7196577 0.81 PPARG (0.40) PPARGPPARDPPARAAKT1

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones STATENS SERUM INSTITUTE (DK) 2003-04-03 US claimed

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones AKR1C3, AKR1C1, AKR1A1 PPARG 659/4885PPARD 405/4885PPARA 600/4885

“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.