SCHEMBL17859319

SCHEMBL17859319

Cc1cn([C@@H](O[C@H](O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(C)C)c(=S)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
POLA1 P09884 1/20 0.39
POLD1 P28340 1/20 0.39
P2RY2 P41231 7/20 0.33
TYMP P19971 4/20 0.33
P2RY4 P51582 3/20 0.33
P2RY6 Q15077 1/20 0.31
ENPP1 P22413 2/20 0.31
TK1 P04183 3/20 0.31
POLG P54098 1/20 0.30

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
SCHEMBL17859331 0.83 POLB (0.31) POLBPOLA1POLD1P2RY2P2RY4
SCHEMBL16299256 0.78 POLB (0.43) POLBPOLA1POLD1P2RY2TYMP
SCHEMBL17859315 0.77 POLB (0.35) POLBPOLA1POLD1P2RY2TYMP
SCHEMBL16575823 0.71 P2RY2 (0.34) POLBPOLA1POLD1P2RY2P2RY4
SCHEMBL21418844 0.69 P2RY2 (0.45) POLA1P2RY2P2RY4P2RY6ENPP1
SCHEMBL28563636 0.69 POLB (0.38) POLBPOLA1POLD1P2RY2TYMP
SCHEMBL23805468 0.69 TYMP (0.43) POLBPOLA1POLD1P2RY2TYMP
SCHEMBL16575819 0.68 P2RY2 (0.44) POLA1P2RY2P2RY4P2RY6ENPP1
SCHEMBL16576112 0.67 POLG (0.37) P2RY2P2RY4P2RY6ENPP1POLG
SCHEMBL16575829 0.66 P2RY2 (0.31) P2RY2P2RY4P2RY6ENPP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016099982-A2 PHOSPHORAMIDATES FOR THE TREATMENT OF HEPATITIS B VIRUS EMORY UNIVERSITY (US) 2016-06-23 WO disclosed