SCHEMBL9780938

SCHEMBL9780938

CCOC(=O)/C=C/[C@@H]1O[C@H](n2cc(CC)c(=O)[nH]c2=O)CC1OC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.41
TK2 O00142 1/20 0.41
RNASE1 P07998 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
SCHEMBL9780934 1.00 TK1 (0.41) TK1TK2RNASE1
SCHEMBL9780941 1.00 TK1 (0.41) TK1TK2RNASE1
SCHEMBL9644408 0.85 RNASE1 (0.43) TK1RNASE1
SCHEMBL9644415 0.85 RNASE1 (0.43) TK1RNASE1
SCHEMBL9644403 0.85 RNASE1 (0.43) TK1RNASE1
SCHEMBL9646549 0.84 RNASE1 (0.44) RNASE1
SCHEMBL9646559 0.84 RNASE1 (0.44) RNASE1
SCHEMBL9646568 0.84 RNASE1 (0.44) RNASE1
SCHEMBL9646443 0.84 RNASE1 (0.43) RNASE1
SCHEMBL9646425 0.84 RNASE1 (0.43) RNASE1

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