SCHEMBL21134972

SCHEMBL21134972

CC(=O)OC[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](COC(=O)c3ccccc3)O[C@@H]2COC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.50
▸ PTPN1 P18031 2/20 0.47
▸ PAX8 Q06710 1/20 0.47
▸ PRKCA P17252 1/20 0.47
▸ AKT1 P31749 1/20 0.47
▸ PTK2 Q05397 1/20 0.47
▸ ANTXR2 P58335 1/20 0.46
▸ USP2 O75604 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ LMNA P02545 2/20 0.45
▸ CA1 P00915 2/20 0.44
▸ CA2 P00918 2/20 0.44
▸ TMPRSS2 O15393 1/20 0.44
▸ PDE5A O76074 1/20 0.44
▸ HMGCR P04035 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ LCK P06239 1/20 0.44
▸ FYN P06241 1/20 0.44

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
SCHEMBL2528448 0.89 PTPN1 (0.53) TSHRPTPN1PAX8ANTXR2USP2
SCHEMBL7617205 0.89 PTPN1 (0.53) TSHRPTPN1PAX8ANTXR2USP2
SCHEMBL2522369 0.89 PTPN1 (0.53) TSHRPTPN1PAX8ANTXR2USP2
SCHEMBL14020069 0.88 LMNA (0.48) TSHRPAX8PRKCAAKT1PTK2
SCHEMBL14199417 0.87 TSHR (0.47) TSHRPTPN1PAX8PRKCAAKT1
SCHEMBL23266725 0.87 PTPN1 (0.57) TSHRPTPN1PAX8ANTXR2USP2
SCHEMBL15344765 0.86 PAX8 (0.46) TSHRPTPN1PAX8PRKCAAKT1
SCHEMBL23266721 0.86 PTPN1 (0.50) TSHRPTPN1PAX8PRKCAAKT1
SCHEMBL13290315 0.86 PTPN1 (0.46) PTPN1ANTXR2USP2KMT2AMEN1
SCHEMBL17779864 0.86 PTPN1 (0.46) PTPN1ANTXR2USP2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210009620-A1 PURE HEPTASULFATED DISACCHARIDES HAVING IMPROVED ORAL BIOAVAILABILITY OPKO PHARMACEUTICALS, LLC. 2021-01-14 — — US disclosed
US-10829509-B2 Pure heptasulfated disaccharides having improved oral bioavailability OPKO PHARMACEUTICALS, LLC (US) 2020-11-10 — — US disclosed
US-20190185503-A1 PURE HEPTASULFATED DISACCHARIDES HAVING IMPROVED ORAL BIOAVAILABILITY OPKO PHARMACEUTICALS, LLC. 2019-06-20 — — 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 (3 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-20210009620-A1 PURE HEPTASULFATED DISACCHARIDES HAVING IMPROVED ORAL BIOAVAILABILITY SI, GYS1, UGGT1 TSHR 3796/4885PTPN1 2380/4885PAX8 3828/4885
US-10829509-B2 Pure heptasulfated disaccharides having improved oral bioavailability SI, GYS1, UGGT1 TSHR 3796/4885PTPN1 2380/4885PAX8 3828/4885
US-20190185503-A1 PURE HEPTASULFATED DISACCHARIDES HAVING IMPROVED ORAL BIOAVAILABILITY SI, GYS1, UGGT1 TSHR 3796/4885PTPN1 2380/4885PAX8 3828/4885

“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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