SCHEMBL9780924

SCHEMBL9780924

CCc1cn([C@H]2CC[C@@H](CN)O2)c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.45
TK2 O00142 1/20 0.45
BCHE P06276 1/20 0.40

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
SCHEMBL9780930 1.00 TK1 (0.45) TK1TK2BCHE
SCHEMBL10522602 0.91 TK1 (0.56) TK1TK2BCHE
SCHEMBL10522597 0.91 TK1 (0.56) TK1TK2BCHE
SCHEMBL9780986 0.87 TK1 (0.53) TK1TK2
SCHEMBL2035886 0.87 TK1 (0.53) TK1TK2
SCHEMBL13769962 0.86 TK1 (0.53) TK1BCHE
SCHEMBL14217396 0.81 TK1 (0.44) TK1TK2BCHE
SCHEMBL10449410 0.81 TK1 (0.46) TK1TK2
SCHEMBL14217401 0.80 TK1 (0.40) TK1TK2BCHE
SCHEMBL13366936 0.79 TK1 (0.50) TK1TK2

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-5010060-A Method of treating herpes simplex viral infection employing pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 1991-04-23 US disclosed
US-4851519-A AMIDO NUCLEOSIDES, VIRICIDES HOFFMANN-LA ROCHE INC. (US) 1989-07-25 US disclosed
US-4841039-A 2',3'-dideoxy-5-substituted uridines and related compounds as antiviral agents EMORY UNIVERSITY (US) 1989-06-20 US disclosed
US-4681933-A 2',3'-dideoxy-5-substituted uridines and related compounds as antiviral agents UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1987-07-21 US disclosed