SCHEMBL8990380

SCHEMBL8990380

Nc1nc2c(ncn2[C@@H](COCc2ccccc2)OCCCP(=O)(O)O)c(=O)[nH]1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 11/20 0.57
PNP P00491 11/20 0.55

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
SCHEMBL8990385 1.00 HPRT1 (0.57) HPRT1PNP
SCHEMBL8990304 0.84 HPRT1 (0.62) HPRT1PNP
SCHEMBL9385909 0.84 HPRT1 (0.62) HPRT1PNP
SCHEMBL9747416 0.81 HPRT1 (0.45) HPRT1PNP
SCHEMBL10598150 0.78 HPRT1 (0.44) HPRT1PNP
Hydrochloric Acid SCHEMBL6380562 0.76 HPRT1 (0.51) HPRT1PNP
SCHEMBL8743536 0.74 PNP (0.51) HPRT1PNP
SCHEMBL10994419 0.74 HPRT1 (0.40) HPRT1PNP
SCHEMBL8816230 0.73 HDAC1 (0.35) HPRT1
SCHEMBL8743558 0.73 PNP (0.50) HPRT1PNP

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-5532225-A TREATMENT OF HERPES VIRUS SRI INTERNATIONAL (US) 1996-07-02 US disclosed
WO-1994003466-A1 ACYCLIC PURINE PHOSPHONATE NUCLEOTIDE ANALOGS AS ANTIVIRAL AGENTS, AND RELATED SYNTHETIC METHODS SRI INTERNATIONAL (US) 1994-02-17 WO disclosed