SCHEMBL13415667

SCHEMBL13415667

Nc1ncnc2c1ncn2[C@H]1CC[C@@H](/C=C/P(=O)(O)O)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADA P00813 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ PI4KA P42356 2/20 0.50
▸ PI4K2B Q8TCG2 2/20 0.50
▸ PI4K2A Q9BTU6 2/20 0.50
▸ PI4KB Q9UBF8 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ APEX1 P27695 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ADCY1 Q08828 1/20 0.50
▸ ADORA2A P29274 3/20 0.48
▸ ADORA1 P30542 4/20 0.48
▸ P2RY1 P47900 4/20 0.48
▸ P2RY2 P41231 3/20 0.48

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
SCHEMBL26152453 1.00 ADA (0.51) ADAALDH1A1PI4KAPI4K2BPI4K2A
SCHEMBL24181513 1.00 ADA (0.51) ADAALDH1A1PI4KAPI4K2BPI4K2A
SCHEMBL26152478 1.00 ADA (0.51) ADAALDH1A1PI4KAPI4K2BPI4K2A
SCHEMBL13415698 0.87 P2RY2 (0.53) ALDH1A1ADORA1P2RY1P2RY2SRC
SCHEMBL13415639 0.86 NT5E (0.46) TP53SMN1; SMN2PDE4DPDE3AAHCY
SCHEMBL13415712 0.84 YTHDC1 (0.51) ADORA2AADORA1P2RY1PDE4DADORA3
SCHEMBL7162148 0.83 PI4KA (0.57) ADAALDH1A1PI4KAPI4K2BPI4K2A
SCHEMBL9548866 0.83 PI4KA (0.57) ADAALDH1A1PI4KAPI4K2BPI4K2A
SCHEMBL26152655 0.82 P2RY1 (0.41) ADAALDH1A1PI4KAPI4K2BPI4K2A
SCHEMBL24181536 0.82 PI4KA (0.52) ADAALDH1A1PI4KAPI4K2BPI4K2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3936514-B1 3'3' CYCLIC DINUCLEOTIDES WITH AN ALKENYLENE INST OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR V V I (CZ) 2023-05-24 — — EP disclosed
US-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 — — US disclosed
US-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-04-29 — — 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-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT SLC29A1, NUDT1, EIF2AK2 ADA 106/4885ALDH1A1 2008/4885PI4KA 267/4885

“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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