SCHEMBL15545976

SCHEMBL15545976

COC(=O)CCN(CCn1cnc2c(Cl)ncnc21)CCP(=O)(O)O

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 19/20 0.64
FDPS P14324 1/20 0.48

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
SCHEMBL15532393 0.89 HPRT1 (0.65) HPRT1
SCHEMBL16617827 0.89 HPRT1 (0.51) HPRT1FDPS
SCHEMBL15532426 0.83 HPRT1 (0.73) HPRT1
SCHEMBL15532359 0.83 HPRT1 (0.58) HPRT1FDPS
SCHEMBL15532396 0.82 HPRT1 (0.91) HPRT1
SCHEMBL9534919 0.81 P2RX7 (0.51) HPRT1FDPS
SCHEMBL15532193 0.79 HPRT1 (0.62) HPRT1
SCHEMBL15532441 0.78 HPRT1 (0.51) HPRT1
SCHEMBL15532429 0.78 HPRT1 (1.00) HPRT1
SCHEMBL15532675 0.77 HPRT1 (1.00) HPRT1

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-2847201-A2 6-OXOPURINE PHOSPHORIBOSYLTRANSFERASE INHIBITORS The University of Queensland (AU) 2015-03-18 EP disclosed
WO-2013166545-A2 6-OXOPURINE PHOSPHORIBOSYLTRANSFERASE INHIBITORS THE UNIVERSITY OF QUEENSLAND (AU) 2013-11-14 WO disclosed