SCHEMBL7068162

SCHEMBL7068162

COc1ccc(C(OC[C@@H]2O[C@H](n3cc(C)c(=O)[nH]c3=O)C(OCCN)C2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TYMP P19971 4/20 0.51
TK2 O00142 9/20 0.42
TK1 P04183 2/20 0.41
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL7068149 1.00 TYMP (0.51) TYMPTK2TK1HSP90AA1
SCHEMBL6515778 0.94 TYMP (0.48) TYMPTK2TK1
SCHEMBL17090761 0.93 TYMP (0.51) TYMPTK2TK1
SCHEMBL31723482 0.93 TYMP (0.51) TYMPTK2TK1
SCHEMBL5502782 0.93 TYMP (0.51) TYMPTK2TK1
SCHEMBL5888977 0.93 TYMP (0.51) TYMPTK2TK1
SCHEMBL315534 0.93 TYMP (0.51) TYMPTK2TK1
SCHEMBL22984025 0.91 TYMP (0.54) TYMPTK2TK1
SCHEMBL7702801 0.91 TYMP (0.54) TYMPTK2TK1
SCHEMBL7702799 0.91 TYMP (0.54) TYMPTK2TK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6593466-B1 Monomer of given formula; modified to increase binding affinity to target DNA or RNA and resist nuclease degradation; useful as therapeutics or diagnostics; gene expression inhibition ISIS PHARMACEUTICALS, INC. 2003-07-15 US disclosed
US-20030092046-A1 Guanidinium functionalized oligomers and methods MANOHARAN MUTHIAH (US) 2003-05-15 US disclosed
US-6534639-B1 Useful for diagnostic, therapeutic and investigative purposes; guanidine group gives enhanced DNA-RNA hybrid binding affinity and/or increased nuclease resistance ISIS PHARMACEUTICALS, INC. 2003-03-18 US disclosed
EP-1206574-A4 GUANIDINIUM FUNCTIONALIZED OLIGOMERS AND METHODS ISIS PHARMACEUTICALS INC (US) 2002-10-16 EP disclosed
EP-1206574-A2 GUANIDINIUM FUNCTIONALIZED OLIGOMERS AND METHODS ISIS PHARMACEUTICALS, INC. (US) 2002-05-22 EP disclosed
WO-2001002423-A9 2'-GUANIDINYL-SUBSTITUTED OLIGONUCLEOTIDES AND GENE EXPRESSION MODULATION THEREWITH ISIS PHARMACEUTICALS INC (US) 2002-05-02 WO disclosed
WO-2001002423-A2 2'-GUANIDINYL-SUBSTITUTED OLIGONUCLEOTIDES AND GENE EXPRESSION MODULATION THEREWITH ISIS PHARMACEUTICALS, INC. (US) 2001-01-11 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-20030092046-A1 Guanidinium functionalized oligomers and methods RNMT, RNGTT, ADAR TYMP 571/4885TK2 428/4885TK1 620/4885

“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.