SCHEMBL918591

SCHEMBL918591

O=C(c1ccccc1)C(O)[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 8/20 0.69
TP53 P04637 1/20 0.67
SLC29A1 Q99808 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
TSHR P16473 2/20 0.65
DNPH1 O43598 1/20 0.61
DOT1L Q8TEK3 1/20 0.61
DNMT1 P26358 1/20 0.61
DNMT3B Q9UBC3 1/20 0.61
P2RX3 P56373 1/20 0.59
P2RX2 Q9UBL9 1/20 0.59
NT5E P21589 1/20 0.58
CYP3A4 P08684 1/20 0.58
NFKB1 P19838 1/20 0.58
BLM P54132 1/20 0.58
PMP22 Q01453 1/20 0.58

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
SCHEMBL918836 0.87 ADORA3 (0.58) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL918127 0.86 ADORA3 (0.55) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL6451793 0.82 CYP3A4 (0.73) ADORA3SLC29A1TSHRCYP3A4NFKB1
SCHEMBL3253858 0.82 ADORA3 (0.81) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL9388463 0.82 ADORA3 (0.81) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL1320875 0.82 ADORA3 (0.64) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL27437734 0.81 ADORA3 (0.76) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL20491589 0.81 ADORA3 (0.78) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL918592 0.81 DNPH1 (0.74) ADORA3TP53SLC29A1TDP1TSHR
SCHEMBL30395396 0.80 DNPH1 (0.64) ADORA3TP53SLC29A1TDP1TSHR

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
US-8252919-B2 2′-hydroxy-protected ribonucleoside derivative and production method thereof KANEKA CORPORATION (JP) 2012-08-28 US disclosed
US-20110009609-A1 2'-HYDROXY-PROTECTED RIBONUCLEOSIDE DERIVATIVE AND PRODUCTION METHOD THEREOF KANEKA CORPORATION (JP) 2011-01-13 US disclosed
EP-2258709-A1 2'-HYDROXYL-PROTECTED RIBONUCLEOSIDE DERIVATIVE AND MANUFACTURING METHOD OF SAME Kaneka Corporation (JP) 2010-12-08 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 (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-20110009609-A1 2'-HYDROXY-PROTECTED RIBONUCLEOSIDE DERIVATIVE AND PRODUCTION METHOD THEREOF RNASEL, RNASEH1, NUDT1 ADORA3 480/4885TP53 3962/4885SLC29A1 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.