SCHEMBL17191734

SCHEMBL17191734

CC#C[C@]1(O)[C@@H]2O[Si](C(C)C)(C(C)C)O[Si](C(C)C)(C(C)C)OC[C@H]2O[C@H]1n1ccc(=O)[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 1/20 0.33
▸ P2RY4 P51582 1/20 0.33
▸ NT5E P21589 1/20 0.31

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
SCHEMBL17192989 1.00 P2RY2 (0.33) P2RY2P2RY4NT5E
SCHEMBL17192971 1.00 P2RY2 (0.33) P2RY2P2RY4NT5E
SCHEMBL17191719 1.00 P2RY2 (0.33) P2RY2P2RY4NT5E
SCHEMBL23225579 0.91 P2RY2 (0.32) P2RY2P2RY4
SCHEMBL15739601 0.91 P2RY2 (0.32) P2RY2P2RY4
SCHEMBL19250773 0.91 P2RY2 (0.32) P2RY2P2RY4
SCHEMBL15739535 0.91 P2RY2 (0.32) P2RY2P2RY4
SCHEMBL17192983 0.91 P2RY2 (0.32) P2RY2P2RY4
SCHEMBL17192969 0.91 P2RY2 (0.32) P2RY2P2RY4
SCHEMBL17191720 0.91 P2RY2 (0.32) P2RY2P2RY4

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-9732111-B2 2′-alkynyl substituted nucleoside derivatives and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2017-08-15 — — US disclosed
US-9732111-B2 2′-alkynyl substituted nucleoside derivatives and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2017-08-15 — — US disclosed
US-20150299243-A1 2'-ALKYNYL SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2015-10-22 — — 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-20150299243-A1 2'-ALKYNYL SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES PNP, SLC29A2, HAVCR2 P2RY2 228/4885P2RY4 257/4885NT5E 25/4885

“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.

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