SCHEMBL20353032

SCHEMBL20353032

COc1ccc(C(OC[C@H]2C[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)C(O[Si](C)(C)C(C)(C)C)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 2/20 0.43
▸ ADORA2A P29274 2/20 0.39
▸ ADORA2B P29275 2/20 0.39
▸ P2RY12 Q9H244 2/20 0.37
▸ P2RY2 P41231 1/20 0.37
▸ P2RY1 P47900 1/20 0.37
▸ P2RY6 Q15077 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ RNASEL Q05823 1/20 0.36

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
SCHEMBL20337209 1.00 TYMP (0.43) TYMPADORA2AADORA2BP2RY12P2RY2
SCHEMBL20348406 0.97 TYMP (0.41) TYMPADORA2AADORA2BP2RY12P2RY2
SCHEMBL20337206 0.95 TYMP (0.43) TYMPADORA2AADORA2BP2RY12ADORA1
SCHEMBL20353027 0.95 TYMP (0.43) TYMPADORA2AADORA2BP2RY12ADORA1
SCHEMBL20348400 0.92 TYMP (0.41) TYMPADORA2AADORA2BP2RY12ADORA1
SCHEMBL17325411 0.90 TYMP (0.46) TYMPADORA2AADORA2B
SCHEMBL20337102 0.87 TYMP (0.41) TYMPADORA2AADORA2BP2RY12ADORA1
SCHEMBL20348403 0.87 TYMP (0.44) TYMPADORA2AADORA2B
SCHEMBL28633882 0.86 TYMP (0.44) TYMPADORA2AADORA2BP2RY12ADORA1
SCHEMBL28635435 0.86 TYMP (0.44) TYMPADORA2AADORA2BP2RY12ADORA1

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-10450341-B2 Cyclic di-nucleotides as modulators of STING GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-10-22 — — US disclosed
EP-3152217-B1 CYCLIC DI-NUCLEOTIDES AS MODULATORS OF STING GLAXOSMITHKLINE IP DEV LTD (GB) 2018-08-01 — — EP disclosed
US-20180186828-A1 CYCLIC DI-NUCLEOTIDES AS MODULATORS OF STING GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 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 (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-10450341-B2 Cyclic di-nucleotides as modulators of STING STING1, CGAS, IRF3 TYMP 423/4885ADORA2A 376/4885ADORA2B 320/4885
US-20180186828-A1 CYCLIC DI-NUCLEOTIDES AS MODULATORS OF STING STING1, CGAS, IRF3 TYMP 423/4885ADORA2A 376/4885ADORA2B 320/4885

“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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