SCHEMBL7571044

SCHEMBL7571044

COOC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1O

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.66
POLB P06746 1/20 0.66
TYMS P04818 1/20 0.58
BCHE P06276 1/20 0.58

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
SCHEMBL6046227 0.91 POLB (0.66) TK1POLBTYMSBCHE
SCHEMBL19101672 0.91 POLB (0.66) TK1POLBTYMSBCHE
SCHEMBL12918450 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL17236294 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL522285 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL4198253 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL17232081 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL135209 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL22943603 0.91 TK1 (0.69) TK1POLBTYMSBCHE
SCHEMBL8163243 0.89 POLB (0.64) TK1POLBTYMS

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
CN-105792832-B Organic compounds for the treatment of hepatitis B virus 诺华股份有限公司 2021-03-23 CN claimed
EP-3083654-A1 4'-OR NUCLEOSIDES FOR THE TREATMENT OF HCV Idenix Pharmaceuticals LLC (US) 2016-10-26 EP claimed
WO-2015095419-A1 4'-OR NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-06-25 WO claimed
EP-0741741-B1 MODIFIED OLIGONUCLEOTIDES NOVARTIS AG (CH) 2002-08-28 EP disclosed
US-6066447-A INCLUDING NUCLEOSIDE DIMERS WITH MODIFIED BACKBONES; FOR VIRICIDES AND ANTISENSE AGENTS NOVARTIS CORPORATION (US) 2000-05-23 US disclosed
EP-0741741-A1 MODIFIED OLIGONUCLEOTIDES Novartis AG (CH) 1996-11-13 EP disclosed
WO-1995020597-A1 MODIFIED OLIGONUCLEOTIDES CIBA-GEIGY AG (CH) 1995-08-03 WO disclosed