SCHEMBL5471540

SCHEMBL5471540

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H]2O[C@@H]21

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.78
▸ PI4KA P42356 2/20 0.75
▸ PI4K2B Q8TCG2 2/20 0.75
▸ PI4K2A Q9BTU6 2/20 0.75
▸ PI4KB Q9UBF8 2/20 0.75
▸ OR51E2 Q9H255 1/20 0.73
▸ ADORA3 P0DMS8 4/20 0.73
▸ ADORA1 P30542 2/20 0.73
▸ ADORA2A P29274 2/20 0.73
▸ DPP4 P27487 1/20 0.73
▸ MEN1 O00255 1/20 0.73
▸ SLC28A1 O00337 1/20 0.73
▸ MAP3K7 O43318 1/20 0.73
▸ SLC28A2 O43868 1/20 0.73
▸ GAPDH P04406 1/20 0.73
▸ MAPK1 P28482 1/20 0.73
▸ ADORA2B P29275 1/20 0.73
▸ STAT6 P42226 1/20 0.73
▸ KMT2A Q03164 1/20 0.73
▸ SMN1; SMN2 Q16637 1/20 0.73

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
SCHEMBL22027656 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL28984635 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL2585481 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL14565272 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL5472130 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL5471536 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL23982184 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL5472127 1.00 GAA (0.78) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL16351393 0.90 GAA (0.81) GAAPI4KAPI4K2BPI4K2API4KB
SCHEMBL2036682 0.90 GAA (0.81) GAAPI4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63159393-A — — None — — JP disclosed
US-20210338706-A1 ADENOSINE ANALOG AND ITS USE IN REGULATING THE CIRCADIAN CLOCK NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-11-04 — — US disclosed
US-9771578-B2 Phosphorous-linked oligomeric compounds and their use in gene modulation IONIS PHARMACEUTICALS, INC. (US) 2017-09-26 — — US disclosed
US-20160076031-A1 PHOSPHOROUS-LINKED OLIGOMERIC COMPOUNDS AND THEIR USE IN GENE MODULATION ISIS PHARMACEUTICALS, INC. (US) 2016-03-17 — — US disclosed
US-20070065922-A1 Biocatalytic synthesis of aminodeoxy purine N9-beta-D-nucleosides containing 3-amino-3-deoxy-beta-D-ribofuranose, 3-amino-2,3-dideoxy-beta-D-ribofuranose, and 2-amino-2-deoxy-beta-D-ribofuranose as sugar moieties METKINEN OY (FI) 2007-03-22 — — US disclosed
US-20050042647-A1 Phosphorous-linked oligomeric compounds and their use in gene modulation ISIS PHARMACEUTICALS, INC. 2005-02-24 — — US disclosed
US-20040254358-A1 Phosphorous-linked oligomeric compounds and their use in gene modulation ISIS PHARMACEUTICALS, INC. 2004-12-16 — — US disclosed
US-20040171028-A1 Phosphorous-linked oligomeric compounds and their use in gene modulation ISIS PHARMACEUTICALS, INC. 2004-09-02 — — US disclosed
WO-2004044134-A2 PHOSPHOROUS-LINKED OLIGOMERIC COMPOUNDS AND THEIR USE IN GENE MODULATION ISIS PHARMACEUTICALS, INC. (US) 2004-05-27 — — WO disclosed
US-5571799-A (2'-5') oligoadenylate analogues useful as inhibitors of host-v5.-graft response BASCO, LTD. (US) 1996-11-05 — — US disclosed
JP-S63159393-A 8-HALOGENOCORDYCEPIN AND PRODUCTION THEREOF KIKKOMAN CORP 1988-07-02 — — JP 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 (5 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-20040171028-A1 Phosphorous-linked oligomeric compounds and their use in gene modulation RTCB, PHAX, RRBP1 GAA 3392/4885PI4KA 1837/4885PI4K2B 1086/4885
US-20070065922-A1 Biocatalytic synthesis of aminodeoxy purine N9-beta-D-nucleosides containing 3-amino-3-deoxy-beta-D-ribofuranose, 3-amino-2,3-dideoxy-beta-D-ribofuranose, and 2-amino-2-deoxy-beta-D-ribofuranose as sugar moieties DUT, UNG, GALE GAA 138/4885PI4KA 3568/4885PI4K2B 3607/4885
US-20210338706-A1 ADENOSINE ANALOG AND ITS USE IN REGULATING THE CIRCADIAN CLOCK PER2, CRY1, ADORA2A GAA 4788/4885PI4KA 2019/4885PI4K2B 2294/4885
US-20040254358-A1 Phosphorous-linked oligomeric compounds and their use in gene modulation RTCB, PHAX, RRBP1 GAA 3392/4885PI4KA 1837/4885PI4K2B 1086/4885
US-20050042647-A1 Phosphorous-linked oligomeric compounds and their use in gene modulation RTCB, PHAX, RRBP1 GAA 3392/4885PI4KA 1837/4885PI4K2B 1086/4885

“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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