SCHEMBL9035660

SCHEMBL9035660

Nc1nc(N)c2ncn([C@H]3CO[C@H](CO)S3)c2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 3/20 0.52
▸ HSP90B1 P14625 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ NT5E P21589 2/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ PNP P00491 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ ADORA2A P29274 2/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ CDK1 P06493 1/20 0.40
▸ CCNB1 P14635 1/20 0.40
▸ CCNE1 P24864 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ ADORA2B P29275 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39

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
SCHEMBL8469441 1.00 AHCY (0.52) AHCYHSP90B1LMNANT5EHIF1A
SCHEMBL9035740 0.88 NT5E (0.41) AHCYLMNANT5EPNPTP53
SCHEMBL8470470 0.88 NT5E (0.41) AHCYLMNANT5EPNPTP53
SCHEMBL8167034 0.81 AHCY (0.50) AHCYHSP90B1LMNANT5EHIF1A
SCHEMBL9706998 0.80 STING1 (0.51) PNPPDE3AADORA3
SCHEMBL9706999 0.80 STING1 (0.51) PNPPDE3AADORA3
SCHEMBL9707001 0.80 STING1 (0.51) PNPPDE3AADORA3
SCHEMBL9114703 0.78 AHCY (0.54) AHCYHSP90B1LMNANT5EHIF1A
SCHEMBL9114712 0.78 AHCY (0.54) AHCYHSP90B1LMNANT5EHIF1A
SCHEMBL9445334 0.77 AHCY (0.62) AHCYHSP90B1LMNANT5EHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0560794-B1 SUBSTITUTED 1,3-OXATHIOLANES WITH ANTIVIRAL PROPERTIES IAF BIOCHEM INT (CA) 1996-09-18 — — EP claimed
EP-0560794-A1 SUBSTITUTED 1,3-OXATHIOLANES AND SUBSTITUTED 1,3-DITHIOLANES WITH ANTIVIRAL PROPERTIES. IAF BIOCHEM INT (CA) 1993-09-22 — — EP claimed
EP-0560794-B1 SUBSTITUTED 1,3-OXATHIOLANES WITH ANTIVIRAL PROPERTIES IAF BIOCHEM INT (CA) 1996-09-18 — — EP disclosed
EP-0560794-A1 SUBSTITUTED 1,3-OXATHIOLANES AND SUBSTITUTED 1,3-DITHIOLANES WITH ANTIVIRAL PROPERTIES. IAF BIOCHEM INT (CA) 1993-09-22 — — EP disclosed
WO-1992008717-A1 SUBSTITUTED 1,3-OXATHIOLANES AND SUBSTITUTED 1,3-DITHIOLANES WITH ANTIVIRAL PROPERTIES BIOCHEM PHARMA INC. (CA) 1992-05-29 — — WO disclosed
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