SCHEMBL6831439

SCHEMBL6831439

COc1ccc(C(=O)N2CCC[C@H]2COP(=O)(O[C@H]2C[C@H](n3ccc(N)nc3=O)O[C@@H]2C(OC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)C(=O)c2ccccc2)N(C(C)C)C(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ST6GAL1 P15907 2/20 0.34
POLB P06746 2/20 0.32
POLG P54098 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
SCHEMBL6833812 1.00 ST6GAL1 (0.34) ST6GAL1POLBPOLG
SCHEMBL6835037 0.88 ST6GAL1 (0.35) ST6GAL1POLB
SCHEMBL6833762 0.88 ST6GAL1 (0.35) ST6GAL1POLB
SCHEMBL6834949 0.86 P2RX3 (0.36) POLB
SCHEMBL6831423 0.86 P2RX3 (0.36) POLB
SCHEMBL6835165 0.85 ST6GAL1 (0.34) ST6GAL1POLBPOLG
SCHEMBL4350930 0.84 ST6GAL1 (0.34) ST6GAL1POLBPOLG
SCHEMBL6835155 0.81 TYMP (0.36) POLB
SCHEMBL6834953 0.81 TYMP (0.36) POLB
SCHEMBL5200194 0.79 POLB (0.37) ST6GAL1POLBPOLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040082774-A1 Novel phosphate and thiophosphate protecting groups ISIS PHARMACEUTICALS, INC. 2004-04-29 US 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-20040082774-A1 Novel phosphate and thiophosphate protecting groups TYMP, MTAP, PPIP5K2 ST6GAL1 2845/4885POLB 30/4885POLG 106/4885

“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.