SCHEMBL17550962

SCHEMBL17550962

CCCCOC1[C@H](O)C(COC(C)=O)O[C@@H](O[Si](C)(C)C(C)(C)C(C)C)[C@H]1N=[N+]=[N-]

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 1/20 0.30

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
SCHEMBL17550983 0.89 TNF (0.30) —
SCHEMBL17551015 0.89 TNF (0.30) —
SCHEMBL17551001 0.89 — —
SCHEMBL17551002 0.87 CYP2D6 (0.33) —
SCHEMBL14864775 0.85 TNF (0.37) TLR4
SCHEMBL16273574 0.85 MAPK1 (0.36) TLR4
SCHEMBL15197978 0.85 MAPK1 (0.36) TLR4
SCHEMBL17549044 0.84 CYP2D6 (0.31) —
SCHEMBL17550991 0.83 PAX8 (0.32) —
SCHEMBL17550999 0.80 ALDH1A1 (0.34) TLR4

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-20160060365-A1 HEPARAN SULFATE SYNTHESIS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2016-03-03 — — 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-20160060365-A1 HEPARAN SULFATE SYNTHESIS HPSE, STT3B, DDOST TLR4 2301/4885

“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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