SCHEMBL9054045

SCHEMBL9054045

CC(COCP(=O)(O)O)N1CNc2c1nc(N)[nH]c2=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
SCHEMBL17601879 0.84 HPRT1 (0.62) HPRT1
SCHEMBL23223497 0.83 HPRT1 (0.69) HPRT1PNP
Ethylene SCHEMBL8752206 0.83 HPRT1 (0.60) HPRT1
SCHEMBL8895418 0.80 HPRT1 (0.60) HPRT1PNP
SCHEMBL9858182 0.80 HPRT1 (0.62) HPRT1PNP
SCHEMBL9576807 0.80 HPRT1 (0.67) HPRT1PNP
Ammonia Solution, Strong SCHEMBL9126239 0.79 HPRT1 (0.65) HPRT1PNP
SCHEMBL9417162 0.79 HPRT1 (0.72) HPRT1PNP
SCHEMBL9054484 0.78 HPRT1 (0.71) HPRT1PNP
SCHEMBL27688030 0.78 HPRT1 (0.53) 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
EP-0269947-B2 Antiviral phosphonomethoxyalkylene purine and pyrimidine derivatives ACAD OF SCIENCE CZECH REPUBLIC (CS) 1996-10-16 EP claimed
EP-0269947-A1 Antiviral phosphonomethoxyalkylene purine and pyrimidine derivatives INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1988-06-08 EP claimed