SCHEMBL12798042

SCHEMBL12798042

CC(=O)OC[C@H]1O[C@@H](OC[C@@H]2OC(c3ccccc3)O[C@H]([C@H]3COC(C)(C)O3)[C@@H]2O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.48
▸ PAX8 Q06710 1/20 0.43
▸ PRKCA P17252 1/20 0.43
▸ AKT1 P31749 1/20 0.43
▸ PTK2 Q05397 1/20 0.43
▸ CA9 Q16790 7/20 0.42
▸ CA2 P00918 7/20 0.42
▸ CA1 P00915 6/20 0.42
▸ LMNA P02545 2/20 0.42
▸ CA12 O43570 3/20 0.40
▸ CA14 Q9ULX7 2/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39

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
SCHEMBL12798043 0.92 TSHR (0.47) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL5578523 0.92 TSHR (0.48) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL16317613 0.87 TSHR (0.41) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL23591488 0.79 TSHR (0.56) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL15083009 0.77 TSHR (0.52) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL16317615 0.76 ALDH1A1 (0.41) TSHR
SCHEMBL12604240 0.75 TSHR (0.42) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL28635604 0.74 L3MBTL1 (0.51) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL12798061 0.74 CA2 (0.44) TSHRCA9CA2CA1CA12
SCHEMBL14199405 0.74 ALDH1A1 (0.54) PAX8PRKCAAKT1PTK2CA9

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-7902158-B2 Polysulfated glycosides and salts thereof Ivax Drug Research Ltd. (HU) 2011-03-08 — — US disclosed
US-20070281893-A1 Polysulfated Glycosides And Salts Thereof IVAX DRUG RESEARCH INSTITUTE LTD (HU) 2007-12-06 — — 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-20070281893-A1 Polysulfated Glycosides And Salts Thereof CFTR, AREG, STS TSHR 4117/4885PAX8 4598/4885PRKCA 1961/4885

“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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