SCHEMBL6934755

SCHEMBL6934755

Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.76
LMNA P02545 1/20 0.75
NT5E P21589 1/20 0.75
HIF1A Q16665 1/20 0.75
ADORA2A P29274 6/20 0.73
ADORA2B P29275 4/20 0.73
ADORA1 P30542 1/20 0.69
DPP4 P27487 1/20 0.69

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
SCHEMBL25756712 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL7932653 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL314542 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL259446 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL6725190 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL14131245 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL24146779 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL13461111 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL10040218 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A
SCHEMBL278293 1.00 ADORA3 (0.76) ADORA3LMNANT5EHIF1AADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170216340-A1 A Nucleoside Derivative For Use As A Drug, Particularly For The Treatment Of Chronic Lymphocytic Leukemia INST BIOLOGII MEDYCZNEJ POLSKIEJ AKADEMII NAUK (PL) 2017-08-03 US disclosed
WO-2016020858-A2 A NUCLEOSIDE DERIVATIVE FOR USE AS A DRUG, PARTICULARLY FOR THE TREATMENT OF CHRONIC LYMPHOCYTIC LEUKEMIA INSTYTUT BIOLOGII MEDYCZNEJ POLSKIEJ AKADEMII NAUK (PL) 2016-02-11 WO disclosed
US-20100290990-A1 METHOD FOR PREPARING A MARKED PURINE DERIVATIVE, SAID DERIVATIVE AND USES THEREOF BARRE LOUISA 2010-11-18 US disclosed
EP-0967220-B1 Novel arabinosyladenine derivatives NIPPON ZOKI PHARMACEUTICAL CO (JP) 2003-04-09 EP disclosed
US-6242429-B1 ANTIVIRAL ARA-A DERIVATIVES HAVING RESISTANCE TO METABOLISM BY ADENOSINEDEAMINASE NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2001-06-05 US disclosed
EP-0967220-A1 Novel arabinosyladenine derivatives NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1999-12-29 EP 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 (2 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-20170216340-A1 A Nucleoside Derivative For Use As A Drug, Particularly For The Treatment Of Chronic Lymphocytic Leukemia ENTPD5, DCTD, TYMP ADORA3 266/4885LMNA 1543/4885NT5E 50/4885
US-20100290990-A1 METHOD FOR PREPARING A MARKED PURINE DERIVATIVE, SAID DERIVATIVE AND USES THEREOF TPMT, NUDT1, DUT ADORA3 92/4885LMNA 3403/4885NT5E 19/4885

“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.