SCHEMBL19974597

SCHEMBL19974597

COc1ccc(COC[C@H]2OC(OC(C)=O)[C@](C)(COC(=O)c3ccccc3)[C@@H]2O[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.36
TBXAS1 P24557 1/20 0.35
PTPN1 P18031 4/20 0.33
CACNA1S Q13698 1/20 0.33
FABP7 O15540 1/20 0.33
FABP5 Q01469 1/20 0.33
P2RX4 Q99571 1/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
DHODH Q02127 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
SCHEMBL19974567 0.89 TBXAS1 (0.37) NT5ETBXAS1FABP7FABP5P2RX4
SCHEMBL22700167 0.81 TBXAS1 (0.35) NT5ETBXAS1DHODH
SCHEMBL19979256 0.77 NT5E (0.39) NT5ETDP1
SCHEMBL19975506 0.77 NT5E (0.39) NT5ETDP1
SCHEMBL19979255 0.71 PDE2A (0.37) NT5ETBXAS1TDP1
SCHEMBL19979002 0.71 PDE2A (0.33) NT5ETBXAS1TDP1DHODH
SCHEMBL19974443 0.70 KMT2A (0.45) NT5ESLC6A2SLC6A3KMT2ATDP1
SCHEMBL22700154 0.70 GJB2 (0.38) NT5EKMT2A
SCHEMBL19974398 0.69 ALDH1A1 (0.49) SLC6A2SLC6A3KMT2ATDP1
SCHEMBL26558064 0.69 GLA (0.34)

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 NT5E 20/4885TBXAS1 322/4885PTPN1 2839/4885

“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.