SCHEMBL6092792

SCHEMBL6092792

CCOC(=O)C(C)(C)Oc1ccc(CC(C#N)(O[Si](C)(C)C(C)(C)C)c2c(OC)cccc2OC)cc1-c1cccs1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.35
TNFRSF1A P19438 4/20 0.34
MAPT P10636 4/20 0.34
TSHR P16473 2/20 0.34
HPGD P15428 1/20 0.34
GAA P10253 2/20 0.34
KMT2A Q03164 2/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ERN1 O75460 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6091509 0.88 TNFRSF1A (0.37) TNFRSF1AMAPTTSHRHPGDGAA
SCHEMBL6091637 0.78 TNFRSF1A (0.41) DRD2TNFRSF1AMAPTHPGDGAA
SCHEMBL6091521 0.77 PPARA (0.44) DRD2MAPTTSHRKMT2APPARG
SCHEMBL6093172 0.77 MAPT (0.39) TNFRSF1AMAPTTSHRHPGDKMT2A
SCHEMBL6091552 0.76 ALDH1A1 (0.41) TNFRSF1AMAPTTSHRHPGDGAA
SCHEMBL6092805 0.75 KDM4E (0.41) TNFRSF1AMAPTTSHRHPGDGAA
SCHEMBL6092109 0.75 ALDH1A1 (0.41) TNFRSF1AMAPTTSHRHPGDGAA
SCHEMBL6091886 0.75 PPARA (0.40) DRD2TSHRPPARGPPARA
SCHEMBL6091021 0.70 ALDH1A1 (0.40) TNFRSF1AMAPTTSHRHPGDGAA
SCHEMBL6092897 0.70 ACLY (0.39) TNFRSF1AMAPTTSHRHPGDGAA

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 DRD2 1885/4885TNFRSF1A 4880/4885MAPT 1784/4885

“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.