SCHEMBL5326841

SCHEMBL5326841

Cc1ccc(S[C@@H]2O[C@H](CO)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 5/20 0.44
TACR2 P21452 1/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
SLC6A2 P23975 1/20 0.39
SSTR4 P31391 2/20 0.38
SSTR5 P35346 2/20 0.38
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
LGALS9 O00182 1/20 0.37
LGALS1 P09382 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL5326029 1.00 LGALS3 (0.44) LGALS3TACR2CA12CA1CA2
SCHEMBL19818851 0.99 LGALS3 (0.43) LGALS3TACR2CA12CA1CA2
SCHEMBL28529577 0.92 LGALS3 (0.51) LGALS3SLC6A2SSTR4SSTR5LGALS9
SCHEMBL15422703 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2
SCHEMBL3489622 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2
SCHEMBL15652660 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2
SCHEMBL13498636 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2
SCHEMBL5688674 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2
SCHEMBL20169071 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2
SCHEMBL8335055 0.90 TACR2 (0.42) LGALS3TACR2CA12CA1CA2

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
WO-2007109561-A1 IMMUNOMODULATORY SACCHARIDE COMPOUNDS UNIVERSITY OF ALBERTA (CA) 2007-09-27 WO disclosed
US-20070219144-A1 IMMUNOMODULATORY SACCHARIDE COMPOUNDS UNIVERSITY OF ALBERTA 2007-09-20 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-20070219144-A1 IMMUNOMODULATORY SACCHARIDE COMPOUNDS MTX1, MTX2, CSGALNACT1 LGALS3 76/4885TACR2 4597/4885CA12 2961/4885

“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.