SCHEMBL2779773

SCHEMBL2779773

Nc1nc(-c2cc(F)c(F)c(F)c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.70
NT5E P21589 1/20 0.70
HIF1A Q16665 1/20 0.70
ADORA2A P29274 10/20 0.64
ADORA2B P29275 4/20 0.63
ADORA3 P0DMS8 2/20 0.61
ADORA1 P30542 1/20 0.60

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
SCHEMBL4349253 1.00 LMNA (0.70) LMNANT5EHIF1AADORA2AADORA2B
SCHEMBL2776182 1.00 LMNA (0.70) LMNANT5EHIF1AADORA2AADORA2B
SCHEMBL2774718 0.91 LMNA (0.72) LMNANT5EHIF1AADORA2AADORA2B
SCHEMBL2778969 0.86 LMNA (0.65) LMNANT5EHIF1AADORA2AADORA2B
Fludarabine SCHEMBL13046076 0.83 LMNA (1.00) LMNANT5EHIF1AADORA2AADORA2B
Fludarabine SCHEMBL12018219 0.83 LMNA (1.00) LMNANT5EHIF1AADORA2AADORA2B
Fludarabine SCHEMBL977919 0.83 LMNA (1.00) LMNANT5EHIF1AADORA2AADORA2B
Fludarabine SCHEMBL13046078 0.83 LMNA (1.00) LMNANT5EHIF1AADORA2AADORA2B
Fludarabine SCHEMBL14031844 0.83 LMNA (1.00) LMNANT5EHIF1AADORA2AADORA2B
Fludarabine SCHEMBL12232219 0.83 LMNA (1.00) LMNANT5EHIF1AADORA2AADORA2B

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-2081946-B1 ADENOSINE DERIVATIVES FOR THE TREATMENT OF PAIN CBT DEV LTD (GB) 2012-05-30 EP disclosed
US-7807685-B2 Therapeutic compounds CBT DEVELOPMENT LIMITED (GB) 2010-10-05 US disclosed
US-20080076776-A1 Therapeutic compounds BIOVITRUM AB (SE) 2008-03-27 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-20080076776-A1 Therapeutic compounds FPR3, OGFR, OPRK1 LMNA 3103/4885NT5E 3242/4885HIF1A 902/4885

“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.