SCHEMBL5907189

SCHEMBL5907189

C[C@@]1(S)[C@H](O)[C@@H](CO)O[C@H]1n1ccc2c(=O)[nH]c(N)nc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ SLC29A1 Q99808 1/20 0.43
▸ PNP P00491 2/20 0.40
▸ STING1 Q86WV6 3/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ MDM2 Q00987 1/20 0.36
▸ NCOA1 Q15788 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ADORA2A P29274 2/20 0.36
▸ BCL6 P41182 1/20 0.36

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
SCHEMBL12150844 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL12150032 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL21008084 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL6734193 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL733124 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL12151845 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL12758337 0.89 ADORA2A (0.47) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL12220624 0.88 PDE4D (0.48) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL12194660 0.88 PDE4D (0.48) PDE4DPDE3ASLC29A1PNPSTING1
SCHEMBL18661625 0.88 PDE4D (0.48) PDE4DPDE3ASLC29A1PNPSTING1

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
US-20060122154-A1 Thionucleoside derivatives as inhibitors of rna-dependent rna viral polymerase MERCK SHARP & DOHME CORP. 2006-06-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060122154-A1 Thionucleoside derivatives as inhibitors of rna-dependent rna viral polymerase NSUN3, NSUN2, RNASE1 PDE4D 2307/4885PDE3A 2787/4885SLC29A1 328/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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