SCHEMBL21049964

SCHEMBL21049964

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]cnc43)C[C@@H]2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 14/20 0.49
▸ ALDH1A1 P00352 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ ALB P02768 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ TYMP P19971 1/20 0.41

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
SCHEMBL17037317 1.00 STING1 (0.49) STING1ALDH1A1LMNAALBMAPK1
SCHEMBL8620596 0.86 STING1 (0.46) STING1
SCHEMBL12729604 0.86 STING1 (0.46) STING1
SCHEMBL12352439 0.82 STING1 (0.52) STING1ALDH1A1MAPK1
SCHEMBL12595500 0.82 STING1 (0.52) STING1ALDH1A1MAPK1
SCHEMBL17772331 0.82 STING1 (0.52) STING1ALDH1A1MAPK1
SCHEMBL12222444 0.82 STING1 (0.52) STING1ALDH1A1MAPK1
SCHEMBL8624094 0.82 STING1 (0.52) STING1ALDH1A1MAPK1
SCHEMBL12729578 0.82 STING1 (0.52) STING1ALDH1A1MAPK1
SCHEMBL17860546 0.81 STING1 (0.58) STING1

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-20190175633-A1 REACTIVE, LIPOPHILIC NUCLEOSIDE BUILDING BLOCKS FOR THE SYNTHESIS OF HYDROPHOBIC NUCLEIC ACIDS IONOVATION GMBH (DE) 2019-06-13 — — 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-20190175633-A1 REACTIVE, LIPOPHILIC NUCLEOSIDE BUILDING BLOCKS FOR THE SYNTHESIS OF HYDROPHOBIC NUCLEIC ACIDS NCL, NOP2, HNRNPD STING1 925/4885ALDH1A1 3589/4885LMNA 255/4885

“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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