SCHEMBL19974581

SCHEMBL19974581

COc1ccc(COC[C@H]2OC(=O)[C@](C)(C=O)[C@@H]2O[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
THRB P10828 1/20 0.33
IDO1 P14902 2/20 0.32
AGXT P21549 2/20 0.32
TLR9 Q9NR96 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
GJB2 P29033 1/20 0.30
GJA1 P17302 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
SCHEMBL19979038 1.00 GLA (0.33) GLANPSR1THRBIDO1AGXT
SCHEMBL19978973 0.91 GLA (0.32) GLANPSR1THRBIDO1AGXT
SCHEMBL19974420 0.91 GLA (0.32) GLANPSR1THRBIDO1AGXT
SCHEMBL22700173 0.88 GLA (0.35) GLANPSR1THRBIDO1AGXT
SCHEMBL26558064 0.86 GLA (0.34) GLANPSR1THRBIDO1AGXT
SCHEMBL19974571 0.84 HDAC4 (0.33) GLANPSR1THRBIDO1AGXT
SCHEMBL19978918 0.84 HDAC4 (0.33) GLANPSR1THRBIDO1AGXT
SCHEMBL22700167 0.77 TBXAS1 (0.35) THRB
SCHEMBL26558053 0.75 GLA (0.39) GLANPSR1IDO1AGXTTLR9
SCHEMBL26558068 0.74 MMP1 (0.34) GLANPSR1THRBHDAC4HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11434255-B2 Nucleoside and nucleotide analogues bearing a quaternary all-carbon stereogenic center at the 2′ position and methods of use as a cardioprotective agent LCB PHARMA INC. (CA) 2022-09-06 US disclosed
EP-3512860-B1 NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT LCB PHARMA INC (CA) 2020-11-25 EP disclosed
EP-3512860-A1 NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT LCB Pharma Inc. (CA) 2019-07-24 EP disclosed
WO-2018049534-A1 NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT LCB PHARMA INC. (CA) 2018-03-22 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-11434255-B2 Nucleoside and nucleotide analogues bearing a quaternary all-carbon stereogenic center at the 2′ position and methods of use as a cardioprotective agent TNNT2, NT5C2, PNP GLA 3619/4885NPSR1 3741/4885THRB 3070/4885

“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.