SCHEMBL13239682

SCHEMBL13239682

CC[C@H]1O[C@@H](n2cnc3c(Oc4ccc([N+](=O)[O-])cc4)ncnc32)C[C@H]1C

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 9/20 0.48
HIF1A Q16665 2/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
ABCC4 O15439 1/20 0.38
SLC28A3 Q9HAS3 1/20 0.38
BLM P54132 1/20 0.38
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL15165604 1.00 SLC29A1 (0.48) SLC29A1HIF1ATP53CYP3A4ABCC4
SCHEMBL13239695 0.91 HIF1A (0.43) SLC29A1HIF1AHPGD
SCHEMBL15165603 0.86 HPGD (0.43) SLC29A1HIF1AHPGD
SCHEMBL13239681 0.86 HPGD (0.43) SLC29A1HIF1AHPGD
SCHEMBL13239688 0.84 SLC29A1 (0.46) SLC29A1HIF1ATP53CYP3A4ABCC4
SCHEMBL15165605 0.84 SLC29A1 (0.46) SLC29A1HIF1ATP53CYP3A4ABCC4
SCHEMBL15165611 0.84 DNPH1 (0.40) SLC29A1HIF1AHPGD
SCHEMBL13239673 0.80 HIF1A (0.46) SLC29A1HIF1A
SCHEMBL15165599 0.80 HIF1A (0.46) SLC29A1HIF1A
SCHEMBL13239672 0.80 HIF1A (0.46) HIF1A

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-20100179312-A1 CONVERTIBLE NUCLEOSIDE DERIVATIVES LAKSHMAN MAHESH K 2010-07-15 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-20100179312-A1 CONVERTIBLE NUCLEOSIDE DERIVATIVES PNP, NUDT1, NUDT14 SLC29A1 19/4885HIF1A 3959/4885TP53 4142/4885

“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.