SCHEMBL9857698

SCHEMBL9857698

CCOP(=O)(COCCCC(O)On1cnc2c(=O)[nH]c(N)nc21)OCC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PNP P00491 7/20 0.50
HPRT1 P00492 9/20 0.48
POLB P06746 2/20 0.45
USP2 O75604 1/20 0.45
TSHR P16473 1/20 0.45
EDNRA P25101 1/20 0.45
HTR2A P28223 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
HBB P68871 1/20 0.45
HSD17B10 Q99714 1/20 0.45
POLG P54098 2/20 0.44
POLA1 P09884 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL9858344 0.88 HPRT1 (0.58) PNPHPRT1POLBPOLGPOLA1
SCHEMBL9857691 0.86 BLM (0.50) PNPHPRT1POLBUSP2TSHR
SCHEMBL9858353 0.85 PNP (0.52) PNPHPRT1POLBUSP2TSHR
SCHEMBL9417134 0.83 PNP (0.51) PNPHPRT1POLBUSP2TSHR
SCHEMBL9858115 0.82 HPRT1 (0.63) PNPHPRT1POLBPOLGPOLA1
SCHEMBL9857602 0.82 BLM (0.52) PNPHPRT1USP2TSHREDNRA
SCHEMBL9858137 0.81 SLC22A6 (0.47) POLGPOLA1
SCHEMBL9857618 0.80 PNP (0.47) PNPHPRT1POLBUSP2TSHR
SCHEMBL9182617 0.80 TK1 (0.57) PNPHPRT1USP2TSHREDNRA
SCHEMBL8717128 0.78 POLB (0.68) PNPHPRT1POLBUSP2TSHR

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 3 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
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