SCHEMBL7100238

SCHEMBL7100238

OC[C@H]1NC(c2c[nH]c3c(O)nc(O)nc23)[C@H](O)[C@@H]1O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PNP P00491 14/20 0.60
HPRT1 P00492 2/20 0.45
MTAP Q13126 4/20 0.44

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
SCHEMBL506019 1.00 PNP (0.60) PNPHPRT1MTAP
SCHEMBL5606739 1.00 PNP (0.60) PNPHPRT1MTAP
Hydrochloric Acid SCHEMBL4065724 0.99 PNP (0.59) PNPHPRT1MTAP
SCHEMBL505709 0.87 PNP (0.64) PNPHPRT1MTAP
SCHEMBL14156772 0.87 PNP (0.58) PNPMTAP
SCHEMBL8246938 0.87 PNP (0.64) PNPHPRT1MTAP
SCHEMBL5606527 0.87 PNP (0.64) PNPHPRT1MTAP
Hydrochloric Acid SCHEMBL4830734 0.86 PNP (0.63) PNPHPRT1MTAP
SCHEMBL4840335 0.83 HPRT1 (0.48) PNPHPRT1MTAP
Forodesine SCHEMBL506383 0.82 PNP (0.75) PNPMTAP

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
EP-1165564-A4 PROCESS FOR PREPARING INHIBITORS OF NUCLEOSIDE METABOLISM IND RES LTD (NZ) 2003-01-22 EP claimed
EP-1165564-A2 PROCESS FOR PREPARING INHIBITORS OF NUCLEOSIDE METABOLISM INDUSTRIAL RESEARCH LIMITED (NZ) 2002-01-02 EP claimed
WO-2000061783-A2 PROCESS FOR PREPARING INHIBITORS OF NUCLEOSIDE METABOLISM INDUSTRIAL RESEARCH LIMITED (NZ) 2000-10-19 WO claimed