SCHEMBL9684438

SCHEMBL9684438

Nc1nc2c(c(=O)[nH]1)NCN2OCC(CO)CCP(=O)(O)O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 17/20 0.54
PNP P00491 1/20 0.34

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
SCHEMBL9685196 0.87 HPRT1 (0.46) HPRT1PNP
SCHEMBL9683401 0.87 HPRT1 (0.56) HPRT1PNP
SCHEMBL9684202 0.84 HPRT1 (0.60) HPRT1PNP
SCHEMBL9675861 0.82 HPRT1 (0.53) HPRT1
SCHEMBL9684323 0.81 HPRT1 (0.62) HPRT1PNP
SCHEMBL9417241 0.81 HPRT1 (0.74) HPRT1
SCHEMBL9683454 0.80 HPRT1 (0.61) HPRT1PNP
SCHEMBL9685371 0.80 HPRT1 (0.54) HPRT1PNP
SCHEMBL9295538 0.78 HPRT1 (0.51) HPRT1PNP
SCHEMBL9858182 0.77 HPRT1 (0.62) 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-5166198-A Herpes virus infections BEECHAM P.L.C. (GB) 1992-11-24 US disclosed
EP-0404296-A1 Phosphono derivatives of purine with antiviral activity Beecham Group p.l.c. (GB) 1990-12-27 EP disclosed