SCHEMBL8911145

SCHEMBL8911145

Nc1nc(Cl)nc2c1ncn2C[C@@H](CO)OCP(=O)(O)O

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.54
HPRT1 P00492 8/20 0.53
SLC22A6 Q4U2R8 2/20 0.53
CYP3A4 P08684 1/20 0.52
P2RY1 P47900 2/20 0.46
TYMP P19971 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
SCHEMBL172847 0.89 HPRT1 (0.55) FGFR1HPRT1SLC22A6CYP3A4TYMP
SCHEMBL15516660 0.89 HPRT1 (0.55) FGFR1HPRT1SLC22A6CYP3A4TYMP
SCHEMBL29450587 0.89 HPRT1 (0.55) FGFR1HPRT1SLC22A6CYP3A4TYMP
SCHEMBL8421102 0.84 CYP3A4 (0.52) FGFR1HPRT1SLC22A6CYP3A4P2RY1
SCHEMBL8911148 0.84 PDE8A (0.45) HPRT1CYP3A4
SCHEMBL66563 0.83 CYP3A4 (0.73) FGFR1HPRT1SLC22A6CYP3A4
SCHEMBL29437221 0.83 CYP3A4 (0.73) FGFR1HPRT1SLC22A6CYP3A4
SCHEMBL385752 0.83 CYP3A4 (0.73) FGFR1HPRT1SLC22A6CYP3A4
SCHEMBL97303 0.80 HPRT1 (0.51) FGFR1HPRT1SLC22A6CYP3A4
SCHEMBL173060 0.80 HPRT1 (0.81) HPRT1CYP3A4

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-RE35558-E (2R)-2-[di(2-propyl)phosphonyylmethoxy]-3-P-toluenesulfonyloxy-1-trimethylacetoxypropane, its preparation and use INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1997-07-08 US disclosed
US-5130427-A Viricides formed by etherification, esterification and reaction with a phosphonate containing compound CESKOSLOVENSKA AKADEMIE VED (CS) 1992-07-14 US disclosed
EP-0470809-A1 Antiviral nucleosides, compounds useful in their preparation and processes of making them Ceskoslovenska akademie ved (CS) 1992-02-12 EP disclosed