SCHEMBL19728869

SCHEMBL19728869

CC[C@H]1OC(O)[C@@H]2OC(C)(C)OC21

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLB1 P16278 1/20 0.34
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL16980588 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL13170766 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL12745880 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL8324123 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL16079839 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL19129781 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL25495867 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL16883362 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL17680204 1.00 GLB1 (0.34) GLB1CA2CA1CA9ALDH1A1
SCHEMBL19799250 0.88 GLB1 (0.33) GLB1CA2CA1CA9

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-20170360924-A1 HUMAN iNKT CELL ACTIVATION USING GLYCOLIPIDS WITH ALTERED GLYCOSYL GROUPS ACADEMIA SINICA (TW) 2017-12-21 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-20170360924-A1 HUMAN iNKT CELL ACTIVATION USING GLYCOLIPIDS WITH ALTERED GLYCOSYL GROUPS UGCG, GALK1, B3GAT3 GLB1 27/4885CA2 3196/4885CA1 2266/4885

“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.