SCHEMBL18326539

SCHEMBL18326539

Cc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)cc1

nearest known ligand 0.87

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 16/20 0.87
▸ SLC5A2 P31639 8/20 0.87
▸ HPGD P15428 2/20 0.87
▸ HSD17B10 Q99714 2/20 0.87
▸ SLC28A3 Q9HAS3 2/20 0.87
▸ KDM4E B2RXH2 1/20 0.87
▸ CYP3A4 P08684 1/20 0.87
▸ MAPT P10636 1/20 0.87
▸ THRB P10828 1/20 0.87
▸ CYP2C9 P11712 1/20 0.87
▸ CYP2C19 P33261 1/20 0.87
▸ SLC28A2 O43868 1/20 0.87
▸ EPHX2 P34913 1/20 0.87

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
SCHEMBL11938313 1.00 SLC5A1 (0.87) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL113699 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL18058585 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL17290 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL2826870 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL23802544 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL16421567 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL22022720 0.93 SLC5A1 (1.00) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL7647026 0.92 SLC5A1 (0.98) SLC5A1SLC5A2HPGDHSD17B10SLC28A3
Phlorizin SCHEMBL28823647 0.92 SLC5A1 (0.98) SLC5A1SLC5A2HPGDHSD17B10SLC28A3

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-20240216411-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS CLASS I MUTATIONS ANN AND ROBERT H. LURIE CHILDREN'S HOSPITAL OF CHICAGO 2024-07-04 — — US disclosed
US-20160367693-A1 Selective Arylation of Dichalcogenides in Biomolecules NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-12-22 — — 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 (2 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-20160367693-A1 Selective Arylation of Dichalcogenides in Biomolecules SCLY, SELENOI, TPO SLC5A1 3783/4885SLC5A2 3347/4885HPGD 2822/4885
US-20240216411-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS CLASS I MUTATIONS SLC5A1, CFTR, SLC5A2 SLC5A1 1/4885SLC5A2 3/4885HPGD 3815/4885

“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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