SCHEMBL20347305

SCHEMBL20347305

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nc(Cl)nc43)[C@@H](Cl)[C@@H]2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 15/20 0.34
▸ CD79B P40259 1/20 0.34
▸ ADORA3 P0DMS8 4/20 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
Carbamic Acid SCHEMBL19948862 0.84 NT5E (0.31) NT5ECD79B
SCHEMBL20305241 0.80 ADORA3 (0.46) NT5EADORA3
SCHEMBL14946328 0.74 STING1 (0.51) —
SCHEMBL4757808 0.73 ADORA3 (0.54) NT5EADORA3
SCHEMBL20347308 0.73 LMNA (0.52) NT5EADORA3
SCHEMBL22216550 0.73 ADORA3 (0.54) NT5EADORA3
SCHEMBL19961896 0.73 ADORA3 (0.54) NT5EADORA3
SCHEMBL4759035 0.72 ADORA3 (0.41) NT5EADORA3
SCHEMBL14946345 0.72 STING1 (0.45) —
SCHEMBL13030116 0.70 NT5E (0.43) NT5E

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-20180186827-A1 Ectonucleotidase Inhibitors and Methods of Use Thereof ANTENGENE THERAPEUTICS LIMITED (CN) 2018-07-05 — — 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-20180186827-A1 Ectonucleotidase Inhibitors and Methods of Use Thereof NT5E, ENTPD5, NT5C2 NT5E 1/4885CD79B 4495/4885ADORA3 23/4885

“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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