SCHEMBL8933855

SCHEMBL8933855

CC(C)OP(=O)(CO[C@H](C)Cn1nc2[nH]c(N)nc(=O)c2n1)OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 3/20 0.39
FAP Q12884 1/20 0.32
TYMP P19971 1/20 0.30

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
SCHEMBL8933946 1.00 HPRT1 (0.39) HPRT1FAPTYMP
SCHEMBL8934002 0.74 FAP (0.32) FAP
SCHEMBL8934000 0.74 FAP (0.32) FAP
SCHEMBL6899234 0.70 HPRT1 (0.57) HPRT1TYMP
SCHEMBL6898752 0.70 HPRT1 (0.57) HPRT1TYMP
SCHEMBL8934012 0.66 HPRT1 (0.32) HPRT1
SCHEMBL8934200 0.62 FAP (0.32) HPRT1FAP
SCHEMBL8934197 0.62 FAP (0.32) HPRT1FAP
SCHEMBL9312154 0.62 HPRT1 (0.68) HPRT1
SCHEMBL9312160 0.62 HPRT1 (0.68) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996009307-A1 PURINE AND 8-AZAPURINE DERIVATIVES SUITABLE TO THE THERAPEUTIC TREATMENT OF AIDS ISTITUTO SUPERIORE DI SANITA' (IT) 1996-03-28 WO disclosed