SCHEMBL9644141

SCHEMBL9644141

Cc1cn([C@H]2CC(O)[C@@H](CNCc3ccccc3)O2)c(=O)[nH]c1=O

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.61

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
SCHEMBL9642595 1.00 TK1 (0.61) TK1
SCHEMBL9644049 0.90
SCHEMBL9642570 0.90
SCHEMBL9642633 0.89
SCHEMBL9780790 0.85
SCHEMBL9780802 0.85
SCHEMBL8845478 0.85 TK1 (0.65) TK1
SCHEMBL8845484 0.85 TK1 (0.65) TK1
SCHEMBL9780812 0.83
SCHEMBL8655891 0.83 DUT (0.71)

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
EP-0256400-B1 PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THESE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1992-09-23 EP claimed
US-4886785-A VIRICIDES, HERPES SIMPLEX HOFFMANN-LA ROCHE INC. (US) 1989-12-12 US claimed
US-4956346-A URIDINE DERIVATIVES AS VIRICIDES HOFFMANN-LA ROCHE INC. (US) 1990-09-11 US disclosed
US-4886785-A VIRICIDES, HERPES SIMPLEX HOFFMANN-LA ROCHE INC. (US) 1989-12-12 US disclosed