SCHEMBL21391519

SCHEMBL21391519

O=C(C[C@@H]1OC(CO)[C@@H](O)C(O)C1O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.48
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA4 P22748 4/20 0.48
CA5A P35218 4/20 0.48
CA7 P43166 4/20 0.48
CA9 Q16790 4/20 0.48
CA13 Q8N1Q1 3/20 0.48
CA14 Q9ULX7 2/20 0.48
CA3 P07451 1/20 0.48
CA6 P23280 1/20 0.47
LGALS9 O00182 2/20 0.47
LGALS1 P09382 2/20 0.47
LGALS3 P17931 2/20 0.47
LGALS7; LGALS7B P47929 2/20 0.47
HK1 P19367 1/20 0.46
HK2 P52789 1/20 0.46

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
SCHEMBL21391552 1.00 CA12 (0.48) CA12CA1CA2CA4CA5A
SCHEMBL4392915 1.00 CA12 (0.48) CA12CA1CA2CA4CA5A
SCHEMBL21391436 0.86 FGF1 (0.51) CA12CA1CA2CA9CA14
SCHEMBL21391507 0.86 FGF1 (0.51) CA12CA1CA2CA9CA14
SCHEMBL21391537 0.86 FGF1 (0.51) CA12CA1CA2CA9CA14
SCHEMBL14094441 0.86 CA12 (0.60) CA12CA1CA2CA4CA5A
SCHEMBL14094447 0.81 CA12 (0.56) CA12CA1CA2CA9
Dextrose SCHEMBL19252827 0.79 HK1 (0.53) LGALS9LGALS1LGALS3LGALS7; LGALS7BHK1
SCHEMBL27988153 0.77 LGALS9 (0.53) LGALS9LGALS1LGALS3LGALS7; LGALS7BHK1
SCHEMBL9066707 0.77 CA12 (0.45) CA12CA1CA2CA4CA5A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210017211-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2021-01-21 US disclosed
WO-2019182087-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2019-09-26 WO 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-20210017211-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OSTC, FUT6, FUT5 CA12 155/4885CA1 1659/4885CA2 3004/4885

“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.