SCHEMBL23989264

SCHEMBL23989264

Nc1ncnc2c1ncn2[C@@H]1O[C@@]2(CO)COC1C2OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.51
▸ AHCY P23526 3/20 0.50
▸ DOT1L Q8TEK3 3/20 0.45
▸ PI4KA P42356 1/20 0.44
▸ PI4K2B Q8TCG2 1/20 0.44
▸ PI4K2A Q9BTU6 1/20 0.44
▸ PI4KB Q9UBF8 1/20 0.44
▸ PDE4A P27815 1/20 0.43
▸ PDE4B Q07343 1/20 0.43
▸ PDE4C Q08493 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ P2RY12 Q9H244 2/20 0.43
▸ GAA P10253 1/20 0.42
▸ SLC29A1 Q99808 1/20 0.42
▸ ADORA2A P29274 3/20 0.42
▸ CARM1 Q86X55 1/20 0.42
▸ P2RY2 P41231 1/20 0.42
▸ P2RY1 P47900 1/20 0.42

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
SCHEMBL23989265 1.00 ADORA3 (0.51) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL3235909 1.00 ADORA3 (0.51) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL3236868 1.00 ADORA3 (0.51) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL13429417 1.00 ADORA3 (0.51) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL14511243 1.00 ADORA3 (0.51) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL18574251 0.87 ADORA3 (0.49) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL23906524 0.87 ADORA3 (0.49) ADORA3AHCYDOT1LPI4KAPI4K2B
SCHEMBL5696096 0.87 AHCY (0.51) AHCYDOT1LPDE4APDE4BPDE4C
SCHEMBL5696093 0.86 AHCY (0.46) ADORA3AHCYDOT1LPDE4APDE4B
SCHEMBL18520512 0.85 PI4KA (0.51) ADORA3AHCYDOT1LPI4KAPI4K2B

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-20210340169-A1 CYCLIC DINUCLEOTIDE COMPOUND AND USES THEREOF SHANGHAI JEYOU PHARMACEUTICAL CO., LTD. (CN) 2021-11-04 — — 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-20210340169-A1 CYCLIC DINUCLEOTIDE COMPOUND AND USES THEREOF STING1, CGAS, TLR9 ADORA3 353/4885AHCY 2106/4885DOT1L 3758/4885

“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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