SCHEMBL8717128

SCHEMBL8717128

CCOP(=O)(COCCn1cnc2c(=O)[nH]c(N)nc21)OCC

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.68
POLG P54098 2/20 0.66
POLA1 P09884 1/20 0.66
HPRT1 P00492 9/20 0.60
PNP P00491 8/20 0.59
USP2 O75604 1/20 0.57
TSHR P16473 1/20 0.57
EDNRA P25101 1/20 0.57
HTR2A P28223 1/20 0.57
RECQL P46063 1/20 0.57
BLM P54132 1/20 0.57
HBB P68871 1/20 0.57
HSD17B10 Q99714 1/20 0.57

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
SCHEMBL24316171 0.93 POLB (0.67) POLBPOLGPOLA1HPRT1PNP
SCHEMBL17622521 0.91 POLB (0.64) POLBPOLGPOLA1HPRT1PNP
SCHEMBL19470300 0.90 PNP (0.58) POLBPOLGPOLA1HPRT1PNP
SCHEMBL19470231 0.90 POLB (0.57) POLBPOLGPOLA1HPRT1PNP
SCHEMBL8717524 0.90 POLB (0.81) POLBPOLGPOLA1HPRT1PNP
SCHEMBL2734888 0.87 POLB (0.73) POLBPOLGPOLA1HPRT1PNP
SCHEMBL17617639 0.86 POLB (0.67) POLBPOLGPOLA1HPRT1PNP
SCHEMBL24792586 0.85 POLB (0.63) POLBPOLGPOLA1HPRT1PNP
SCHEMBL17617613 0.85 POLB (0.60) POLBPOLGPOLA1HPRT1PNP
SCHEMBL17617664 0.85 POLB (0.62) POLBPOLGPOLA1HPRT1PNP

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-5854228-A Antiviral phosphonomethoxyalkylene purine and pyrimidine derivatives INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1998-12-29 US disclosed
US-5650510-A VIRICIDES OR ANTITUMOR AGENTS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1997-07-22 US disclosed
EP-0269947-B2 Antiviral phosphonomethoxyalkylene purine and pyrimidine derivatives ACAD OF SCIENCE CZECH REPUBLIC (CS) 1996-10-16 EP disclosed
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 disclosed