SCHEMBL6093574

SCHEMBL6093574

COC(=O)CNCS(=O)(=O)c1ccc(CC(C#N)(O[Si](C)(C)C(C)(C)C)c2c(OC)ccc(Br)c2OC)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.31
MMP2 P08253 1/20 0.30
ADAM17 P78536 1/20 0.30

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
SCHEMBL6093577 0.84 TDP1 (0.37)
SCHEMBL6093027 0.82 MAPT (0.35) DRD2
SCHEMBL6091627 0.78 HTT (0.37)
SCHEMBL6091765 0.77 RAB9A (0.32)
SCHEMBL6092286 0.73 POLB (0.34)
SCHEMBL6093531 0.72 IDO1 (0.32)
SCHEMBL6093199 0.71 LMNA (0.37) DRD2MMP2ADAM17
SCHEMBL6091521 0.70 PPARA (0.44) DRD2
SCHEMBL6091531 0.69 MAPT (0.36) DRD2
SCHEMBL6093387 0.64 ALDH1A1 (0.49)

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 1885/4885MMP2 3465/4885ADAM17 2918/4885

“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.