SCHEMBL1276940

SCHEMBL1276940

CCOP(=O)(CCC(=O)OCOC(=O)Cl)OCC

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.46
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL710885 0.83 PPARD (0.54) PPARDTSHRSMN1; SMN2POLBCYP1A2
SCHEMBL7709958 0.82 TSHR (0.40) PPARDTSHRTP53TDP1ALDH1A1
SCHEMBL1276805 0.81 PPARD (0.44) PPARDTSHRSMN1; SMN2POLBCYP1A2
SCHEMBL15951709 0.79 PPARD (0.48) PPARDTSHRTDP1SMN1; SMN2POLB
SCHEMBL7425644 0.77 PPARD (0.56) PPARDTSHRTP53TDP1ALDH1A1
SCHEMBL10877243 0.77 PPARD (0.57) PPARDTSHRSMN1; SMN2POLB
SCHEMBL19513947 0.77 PPARD (0.47) PPARDTSHRTDP1SMN1; SMN2POLB
SCHEMBL1276806 0.77 PPARD (0.43) PPARDTSHRSMN1; SMN2POLBCYP1A2
SCHEMBL11663536 0.77 TSHR (0.58) PPARDTSHRTP53TDP1ALDH1A1
SCHEMBL15951765 0.76 DGKA (0.47) PPARDALDH1A1

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-8901072-B2 Glycopeptide and lipoglycopeptide antibiotics with improved solubility THE MEDICINES COMPANY (US) 2014-12-02 US disclosed
US-20120149632-A1 GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS WITH IMPROVED SOLUBILITY THE MEDICINES COMPANY (US) 2012-06-14 US disclosed
WO-2011019839-A2 GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS WITH IMPROVED SOLUBILITY THE MEDICINES COMPANY (US) 2011-02-17 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-20120149632-A1 GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS WITH IMPROVED SOLUBILITY NGLY1, LGALS3BP, GYPA PPARD 3782/4885TSHR 3204/4885TP53 972/4885

“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.