Sugi Predict

Sugi Predict / Compounds / SCHEMBL9294173

SCHEMBL9294173

SCHEMBL9294173

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

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 1/20 0.37
▸ TK1 P04183 5/20 0.37
▸ TK2 O00142 1/20 0.35

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
SCHEMBL2112758 0.93 TYMP (0.40) TYMPTK1
SCHEMBL5134596 0.86 TK1 (0.40) TYMPTK1TK2
SCHEMBL8592454 0.85 RNASE1 (0.44) TYMPTK1TK2
SCHEMBL2115514 0.83 PYGM (0.45) TYMPTK1TK2
SCHEMBL2114242 0.83 PYGM (0.45) TYMPTK2
SCHEMBL1594780 0.83 TK1 (0.35) TYMPTK1TK2
SCHEMBL6536270 0.82 TK1 (0.39) TYMPTK1TK2
SCHEMBL7535867 0.82 TK1 (0.52) TK1
SCHEMBL2112756 0.82 TK1 (0.37) TK1
SCHEMBL9564565 0.82 TK1 (0.52) TK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0570514-A4 METHYLENE PHOSPHONATE NUCLEOSIDE ANALOGS AND OLIGONUCLEOTIDE ANALOGS MADE THEREFROM GILEAD SCIENCES INC (US) 1994-08-17 — — EP disclosed
EP-0570514-A1 METHYLENE PHOSPHONATE NUCLEOSIDE ANALOGS AND OLIGONUCLEOTIDE ANALOGS MADE THEREFROM GILEAD SCIENCES, INC. (US) 1993-11-24 — — EP disclosed