SCHEMBL17198440

SCHEMBL17198440

CC(=O)OC[C@H]1[C@@H](OC(C)=O)[C@H](n2ccc(=O)[nH]c2=O)O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43
P2RY2 P41231 7/20 0.40
P2RY12 Q9H244 4/20 0.40
P2RY14 Q15391 2/20 0.40
DUT P33316 1/20 0.40
P2RY6 Q15077 3/20 0.40
P2RY4 P51582 1/20 0.39

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
SCHEMBL18503491 0.92 TDP1 (0.41) TDP1LMNATHRBSMN1; SMN2HIF1A
SCHEMBL17198400 0.92 SLC28A1 (0.45) P2RY2P2RY14P2RY6P2RY4
SCHEMBL17198561 0.92 TDP1 (0.40) TDP1P2RY2P2RY12P2RY14DUT
SCHEMBL17198648 0.92 SLC28A1 (0.45) P2RY2P2RY14P2RY6P2RY4
SCHEMBL17198402 0.91 DUT (0.39) TDP1LMNATHRBSMN1; SMN2HIF1A
SCHEMBL17198586 0.90 TDP1 (0.43) TDP1LMNATHRBSMN1; SMN2HIF1A
SCHEMBL18512781 0.90 TDP1 (0.43) TDP1LMNATHRBSMN1; SMN2HIF1A
SCHEMBL18512777 0.89 P2RY2 (0.39) TDP1P2RY2P2RY12P2RY14DUT
SCHEMBL17198611 0.89 P2RY2 (0.39) TDP1P2RY2P2RY12P2RY14DUT
SCHEMBL5960185 0.89 LMNA (0.42) TDP1LMNATHRBSMN1; SMN2HIF1A

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 TDP1 625/4885LMNA 1072/4885THRB 3672/4885
US-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV RB1, NSUN2, METTL3 TDP1 635/4885LMNA 1057/4885THRB 3656/4885

“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.