SCHEMBL9858182

SCHEMBL9858182

Nc1nc2c(c(=O)[nH]1)NCN2OCC(O)COCP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 14/20 0.62
PNP P00491 4/20 0.38

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
SCHEMBL9685371 0.88 HPRT1 (0.54) HPRT1PNP
SCHEMBL9576807 0.86 HPRT1 (0.67) HPRT1PNP
SCHEMBL9683401 0.86 HPRT1 (0.56) HPRT1PNP
Ammonia Solution, Strong SCHEMBL9126239 0.85 HPRT1 (0.65) HPRT1PNP
SCHEMBL9417162 0.85 HPRT1 (0.72) HPRT1PNP
SCHEMBL9857606 0.83 HPRT1 (0.69) HPRT1PNP
SCHEMBL9417241 0.82 HPRT1 (0.74) HPRT1
SCHEMBL9054045 0.80 HPRT1 (0.62) HPRT1PNP
SCHEMBL23223497 0.79 HPRT1 (0.69) HPRT1PNP
SCHEMBL9054484 0.78 HPRT1 (0.71) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US claimed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP claimed
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US disclosed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP disclosed