SCHEMBL9569682

SCHEMBL9569682

Nc1nc2c(ncn2CC(O)/C=C/P(=O)(O)O)c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 15/20 0.61
PNP P00491 5/20 0.58

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
SCHEMBL9569690 1.00 HPRT1 (0.61) HPRT1PNP
SCHEMBL9569450 0.89 HPRT1 (0.60) HPRT1PNP
SCHEMBL9569446 0.89 HPRT1 (0.60) HPRT1PNP
SCHEMBL9294938 0.87 HPRT1 (0.60) HPRT1PNP
SCHEMBL9294925 0.87 HPRT1 (0.60) HPRT1PNP
SCHEMBL9569757 0.82 HPRT1 (0.51) HPRT1PNP
SCHEMBL9569645 0.81 HPRT1 (0.58) HPRT1PNP
SCHEMBL9569605 0.81 HPRT1 (0.58) HPRT1PNP
SCHEMBL21638900 0.81 HPRT1 (0.74) HPRT1PNP
SCHEMBL21638908 0.81 HPRT1 (0.74) HPRT1PNP

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0532423-A1 Novel unsaturated acyclic phosphonate derivatives of purine and pyrimidine MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-17 EP claimed