SCHEMBL17198360

SCHEMBL17198360

CC(=O)OC[C@]1(C)[C@@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H]1OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NT5E P21589 2/20 0.41
TDP1 Q9NUW8 2/20 0.39
DUT P33316 1/20 0.38
SMYD2 Q9NRG4 2/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
P2RY2 P41231 5/20 0.33
P2RY12 Q9H244 4/20 0.33
P2RY14 Q15391 3/20 0.33
P2RY6 Q15077 1/20 0.33

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
SCHEMBL17198357 1.00 NT5E (0.41) NT5ETDP1DUTSMYD2LMNA
SCHEMBL18503494 0.92 NT5E (0.42) NT5ETDP1DUTSMYD2P2RY2
SCHEMBL18503499 0.92 NT5E (0.42) NT5ETDP1DUTSMYD2P2RY2
SCHEMBL17198350 0.82 SLC28A1 (0.44) NT5ETDP1LMNATHRBSMN1; SMN2
SCHEMBL17198440 0.80 TDP1 (0.43) TDP1DUTLMNATHRBSMN1; SMN2
SCHEMBL17198356 0.80 LMNA (0.37) SMYD2LMNA
SCHEMBL13722085 0.79 TDP1 (0.38) NT5ETDP1DUTSMYD2LMNA
SCHEMBL17198400 0.79 SLC28A1 (0.45) P2RY2P2RY14P2RY6
SCHEMBL17198648 0.79 SLC28A1 (0.45) P2RY2P2RY14P2RY6
SCHEMBL18512781 0.78 TDP1 (0.43) NT5ETDP1DUTLMNATHRB

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-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV IDENIX PHARMACEUTICALS LLC (US) 2019-02-12 US disclosed
US-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2017-02-16 US disclosed
WO-2015161137-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-10-22 WO 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-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV RB1, NSUN2, METTL3 NT5E 1352/4885TDP1 625/4885DUT 208/4885
US-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV RB1, NSUN2, METTL3 NT5E 1275/4885TDP1 635/4885DUT 201/4885

“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.