SCHEMBL9893398

SCHEMBL9893398

C[C@]1(COC(=O)c2ccccc2)O[C@@H](n2ccc(NC(=O)c3ccccc3)nc2=O)[C@@H](F)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
ABL1 P00519 1/20 0.49
RIN1 Q13671 1/20 0.49
P2RY6 Q15077 2/20 0.47
P2RY14 Q15391 2/20 0.47
NT5E P21589 1/20 0.47
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
P2RY12 Q9H244 1/20 0.35
ABCB1 P08183 5/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL14853785 0.90 POLB (0.54) POLBABL1RIN1P2RY6P2RY14
SCHEMBL15281825 0.89 POLB (0.50) POLBABL1RIN1P2RY6P2RY14
SCHEMBL19590194 0.88 POLB (0.51) POLBABL1RIN1P2RY6P2RY14
SCHEMBL16377131 0.83 POLB (0.47) POLBABL1RIN1P2RY6P2RY14
SCHEMBL15281846 0.83 POLB (0.47) POLBABL1RIN1P2RY6P2RY14
SCHEMBL22364089 0.82 POLB (0.53) POLBABL1RIN1P2RY6P2RY14
SCHEMBL14946265 0.82 POLB (0.54) POLBABL1RIN1P2RY6P2RY14
SCHEMBL14929129 0.82 POLB (0.54) POLBABL1RIN1P2RY6P2RY14
SCHEMBL18417733 0.82 ABL1 (0.53) POLBABL1RIN1P2RY6P2RY14
SCHEMBL18417721 0.81 POLB (0.44) POLBABL1RIN1P2RY6P2RY14

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-20120149657-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SOUTHERN RESEARCH INSTITUTE (AL) 2012-06-14 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-20120149657-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SLC29A2, DUT, SLC29A1 POLB 248/4885ABL1 1126/4885RIN1 2625/4885

“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.