SCHEMBL3454561

SCHEMBL3454561

COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(NC(=O)c4ccccc4)nc3=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 6/20 0.52
P2RY14 Q15391 2/20 0.52
NT5E P21589 1/20 0.52
TYMP P19971 7/20 0.47
POLB P06746 1/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
P2RY2 P41231 4/20 0.40
P2RY4 P51582 3/20 0.40
ST6GAL1 P15907 1/20 0.39
ADORA3 P0DMS8 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
SCHEMBL30580338 0.95 P2RY6 (0.51) P2RY6P2RY14NT5ETYMPPOLB
SCHEMBL1582637 0.94 TYMP (0.48) P2RY6P2RY14NT5ETYMPP2RY2
SCHEMBL17230913 0.94 TYMP (0.48) P2RY6P2RY14NT5ETYMPP2RY2
SCHEMBL18411645 0.94 TYMP (0.48) P2RY6P2RY14NT5ETYMPP2RY2
SCHEMBL6928957 0.92 P2RY6 (0.55) P2RY6P2RY14NT5ETYMPPOLB
SCHEMBL6932433 0.89 P2RY6 (0.52) P2RY6P2RY14NT5ETYMPPOLB
SCHEMBL17231044 0.88 P2RY6 (0.43) P2RY6P2RY14NT5ETYMPPOLB
SCHEMBL31485531 0.88 P2RY6 (0.55) P2RY6P2RY14NT5ETYMPPOLB
SCHEMBL6930742 0.87 P2RY6 (0.51) P2RY6P2RY14NT5ETYMPPOLB
SCHEMBL3076277 0.87 TYMP (0.45) P2RY6P2RY14NT5ETYMPADORA3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217612-B9 PREPARATION OF RIBONUCLEOTIDE OLIGOMER ST PHARM CO LTD (KR) 2016-02-10 EP disclosed
EP-2217612-B1 PREPARATION OF RIBONUCLEOTIDE OLIGOMER ST PHARM CO LTD (KR) 2015-08-12 EP disclosed
US-8901289-B2 Preparation of nucleotide oligomer ST. PHARM CO., LTD. (KR) 2014-12-02 US disclosed
US-20100273999-A1 Preparation of Nucleotide Oligomer SAMCHULLY PHARM. CO., LTD. (KR) 2010-10-28 US disclosed
EP-2217612-A1 PREPARATION OF NUCLEOTIDE OLIGOMER Samchully Pharm. Co., Ltd. (KR) 2010-08-18 EP disclosed
WO-2009064115-A1 PREPARATION OF NUCLEOTIDE OLIGOMER SAMCHULLY PHARM. CO., LTD. (KR) 2009-05-22 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 (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-20100273999-A1 Preparation of Nucleotide Oligomer NUDT1, SAMHD1, ADAR P2RY6 229/4885P2RY14 296/4885NT5E 7/4885

“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.