SCHEMBL6831398

SCHEMBL6831398

COCCOC1C(O)[C@H](COC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)O[C@@H]1n1ccc(=O)[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYMP P19971 1/20 0.51
P2RY14 Q15391 6/20 0.50
P2RY2 P41231 10/20 0.46
P2RY6 Q15077 8/20 0.46
P2RY4 P51582 4/20 0.44

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
SCHEMBL6831397 1.00 TYMP (0.51) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL4451613 0.93 TYMP (0.51) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL7553293 0.93 TYMP (0.51) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL3721728 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL20828930 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL19549038 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL6284695 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL19709160 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL6284697 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4
SCHEMBL19709158 0.92 TYMP (0.53) TYMPP2RY14P2RY2P2RY6P2RY4

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-20040082774-A1 Novel phosphate and thiophosphate protecting groups ISIS PHARMACEUTICALS, INC. 2004-04-29 US disclosed
US-6610837-B1 Preparation of an oligonucleotide compound of given formula by reacting with given compounds, followed by oxidation or sulfurization ISIS PHARMACEUTICALS, INC. 2003-08-26 US disclosed
WO-2000055179-A1 NOVEL PHOSPHATE AND THIOPHOSPHATE PROTECTING GROUPS ISIS PHARMACEUTICALS, INC. (US) 2000-09-21 WO disclosed
US-6121437-A SYNTHESIS OF OLIGONUCLEOTIDES USING OLIGONUCLEOTIDES OR NUCLEOTIDES WITH PROTECTED INTERNUCLEOSIDIC PHOSPHORUS FUNCTIONALITIES WHICH CAN BE REMOVED UNDER MILD CONDITIONS AND PRODUCE NONTOXIC BY-PRODUCTS ISIS PHARMACEUTICALS, INC. (US) 2000-09-19 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 TYMP 1/4885P2RY14 586/4885P2RY2 824/4885

“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.