SCHEMBL8714487

SCHEMBL8714487

Cc1cn(C2CC(OCP(=O)(O)O)CO2)c(=O)[nH]c1=O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.52
NT5M Q9NPB1 1/20 0.48
POLB P06746 1/20 0.48
TYMP P19971 3/20 0.46

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
SCHEMBL18202481 1.00 TK1 (0.52) TK1NT5MPOLBTYMP
SCHEMBL8707772 0.99 TK1 (0.51) TK1NT5MPOLBTYMP
SCHEMBL8707776 0.89 TK1 (0.47) TK1POLB
SCHEMBL8708917 0.89 TK1 (0.49) TK1POLB
SCHEMBL2697383 0.86 TK1 (0.47) TK1NT5MPOLB
SCHEMBL8713884 0.86 TK1 (0.44) TK1NT5MPOLB
SCHEMBL8708924 0.82 TK1 (0.49) TK1NT5MPOLBTYMP
SCHEMBL8709836 0.82 TK1 (0.58) TK1
SCHEMBL16712304 0.81 TYMP (0.44) TK1NT5MTYMP
SCHEMBL20061215 0.81 TK1 (0.41) TK1POLB

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
US-5837871-A PHOSPHONATE DERIVATIVES; ANTITUMOR AGENTS, VIRICIDES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1998-11-17 US claimed