SCHEMBL8955854

SCHEMBL8955854

Nc1nc2c(ncn2Cc2ccc(C(O)C(F)(F)P(=O)(O)O)cc2)c(=O)[nH]1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PNP P00491 18/20 0.67
HPRT1 P00492 2/20 0.52

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
SCHEMBL8955850 0.83 PNP (0.83) PNPHPRT1
SCHEMBL9235118 0.79 PNP (0.72) PNP
SCHEMBL3303770 0.79 PNP (0.72) PNPHPRT1
SCHEMBL1533549 0.78 PNP (0.77) PNP
SCHEMBL3021041 0.78 PNP (0.77) PNPHPRT1
SCHEMBL8955178 0.77 PNP (1.00) PNP
SCHEMBL8955626 0.77 PNP (0.73) PNPHPRT1
SCHEMBL1262622 0.77 PNP (0.79) PNP
SCHEMBL3308559 0.77 PNP (0.79) PNP
SCHEMBL9506808 0.76 PNP (1.00) PNPHPRT1

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-5538978-A NUCLEOSIDE PHOSPHORYLASE INHIBITORS AS IMMUNOSUPPRESSANTS, ANTILYMPHOMA, ANTILEUKEMIA, VIRICIDES AND ANTIPROTOZOA AGENTS MERRELL PHARMACEUTICALS INC. (US) 1996-07-23 US disclosed
US-5527803-A IMMUNOSUPPRESSANTS, PHOSPHORYLASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1996-06-18 US disclosed
US-5494912-A 9-purinyl phosphonic acid derivitives for treating gout MERRELL PHARMACEUTICALS INC. (US) 1996-02-27 US disclosed
EP-0465297-A1 9-Purinyl phosphonic acid derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-01-08 EP disclosed