Sugi Predict

Sugi Predict / Compounds / SCHEMBL15216189

SCHEMBL15216189

SCHEMBL15216189

COC(C)(C)CO[C@H]1C(O)[C@@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O[C@H]1n1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TK2 O00142 3/20 0.41
▸ TOP2A P11388 4/20 0.38
▸ TK1 P04183 2/20 0.38
▸ TYMP P19971 2/20 0.37
▸ RNASE1 P07998 1/20 0.36

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
SCHEMBL13187768 1.00 TK2 (0.41) TK2TOP2ATK1TYMPRNASE1
SCHEMBL7065021 0.90 TK2 (0.42) TK2TOP2ATK1TYMP
SCHEMBL7065019 0.90 TK2 (0.42) TK2TOP2ATK1TYMP
SCHEMBL261289 0.90 TK2 (0.47) TK2TOP2ATK1TYMPRNASE1
SCHEMBL19812217 0.90 TK2 (0.47) TK2TOP2ATK1TYMPRNASE1
SCHEMBL261288 0.90 TK2 (0.47) TK2TOP2ATK1TYMPRNASE1
SCHEMBL31723480 0.89 TK2 (0.42) TK2TOP2ATK1TYMP
SCHEMBL10643570 0.88 TK2 (0.45) TK2TOP2ATK1TYMPRNASE1
SCHEMBL10647357 0.88 TK2 (0.45) TK2TOP2ATK1TYMPRNASE1
SCHEMBL12265843 0.88 TK2 (0.41) TK2TOP2ATK1TYMPRNASE1

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
EP-2403863-B1 NUCLEIC ACID CHEMICAL MODIFICATIONS ALNYLAM PHARMACEUTICALS INC (US) 2013-08-28 — — EP disclosed