SCHEMBL9780787

SCHEMBL9780787

CCO[C@H]1C[C@H](n2cc(CC)c(=O)[nH]c2=O)O[C@@H]1CN

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.51
TK2 O00142 1/20 0.51

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
SCHEMBL9780793 1.00 TK1 (0.51) TK1TK2
SCHEMBL9780593 0.88 TK1 (0.62) TK1TK2
SCHEMBL9780588 0.88 TK1 (0.62) TK1TK2
SCHEMBL9780789 0.86 RNASE1 (0.46) TK1TK2
SCHEMBL9780799 0.86 RNASE1 (0.46) TK1TK2
SCHEMBL8813675 0.83 TK1 (0.68) TK1TK2
SCHEMBL8813666 0.83 TK1 (0.68) TK1TK2
SCHEMBL9780963 0.80 TK1 (0.46) TK1
SCHEMBL9780967 0.80 TK1 (0.46) TK1
SCHEMBL3388209 0.79 TK1 (0.62) 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 2 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