SCHEMBL6092948

SCHEMBL6092948

CCOC(=O)C(C)(C)Oc1cccc(CC(=O)c2c(OC)ccc(-c3cccs3)c2OC)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.46
PPARG P37231 2/20 0.46
FBP1 P09467 1/20 0.38
TNFRSF1A P19438 4/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
KEAP1 Q14145 1/20 0.36
ABCB11 O95342 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
HTR2A P28223 1/20 0.35
PMP22 Q01453 1/20 0.35
ERN1 O75460 1/20 0.35

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
SCHEMBL6092104 0.90 PPARA (0.42) PPARAPPARGFBP1TNFRSF1AKDM4E
SCHEMBL6093024 0.89 PPARG (0.42) PPARAPPARGTNFRSF1AKDM4EMAPT
SCHEMBL6091995 0.85 PPARA (0.44) PPARAPPARGFBP1TNFRSF1AABCB11
SCHEMBL6091637 0.84 TNFRSF1A (0.41) PPARAPPARGFBP1TNFRSF1AKDM4E
SCHEMBL6092459 0.84 PPARA (0.51) PPARAPPARGFBP1LMNAHPGD
SCHEMBL6093002 0.79 PPARA (0.42) PPARAPPARGTNFRSF1AKDM4EMAPT
SCHEMBL6092987 0.76 ERN1 (0.46) TNFRSF1AKDM4EHPGDMAPTGAA
SCHEMBL6094560 0.76 TNFRSF1A (0.48) FBP1TNFRSF1AKDM4EALDH1A1
SCHEMBL6091596 0.74 TNFRSF1A (0.49) PPARAPPARGTNFRSF1A
SCHEMBL6093492 0.74 ERN1 (0.43) PPARATNFRSF1AKDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ATHEROGENICS, INC. 2006-03-23 US disclosed
WO-2006004903-A2 1,2-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND PHARMACEUTICAL COMPOSITIONS THEREOF ATHEROGENICS, INC. (US) 2006-01-12 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-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ABCB11, CEL, CYP46A1 PPARA 457/4885PPARG 535/4885FBP1 760/4885

“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.