SCHEMBL9054652

SCHEMBL9054652

Cc1nc2c(=O)[nH]c(N)nc2n1CCOCP(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 11/20 0.55
POLB P06746 2/20 0.53
POLA1 P09884 1/20 0.51
POLG P54098 1/20 0.51
PNP P00491 5/20 0.49
TYMP P19971 1/20 0.44

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
SCHEMBL8720000 0.86 HPRT1 (0.64) HPRT1POLBPOLA1POLGPNP
Gs-438 SCHEMBL64567 0.79 POLB (0.80) HPRT1POLBPOLA1POLGPNP
Gs-438 SCHEMBL3497651 0.76 POLB (0.84) HPRT1POLBPOLA1POLGPNP
SCHEMBL10871605 0.75 PNP (0.59) HPRT1PNP
SCHEMBL8905164 0.75 HPRT1 (0.72) HPRT1POLBPOLA1POLGPNP
SCHEMBL8905172 0.74 HPRT1 (0.71) HPRT1POLBPOLA1POLGPNP
SCHEMBL9053832 0.74 HPRT1 (0.74) HPRT1POLBPOLA1POLGPNP
SCHEMBL8717497 0.73 PNP (0.55) HPRT1POLBPOLA1POLGPNP
SCHEMBL2734697 0.73 POLB (0.77) HPRT1POLBPOLA1POLGPNP
SCHEMBL8896276 0.71 HPRT1 (0.81) HPRT1POLBPOLA1POLGPNP

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