SCHEMBL4813331

SCHEMBL4813331

OC[C@H]1S[C@@H](Oc2ccc(Cl)cc2Cc2cccc(F)c2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTR2B P41595 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
SLC5A1 P13866 12/20 0.38
SLC5A2 P31639 12/20 0.38
PTGER1 P34995 6/20 0.38
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL4813340 1.00 HTR2C (0.39) HTR2CSLC6A4HTR2BPPARGPPARA
SCHEMBL4810726 0.86 CNR1 (0.37) SLC6A4SLC5A1SLC5A2PTGER1
SCHEMBL4810721 0.86 CNR1 (0.37) SLC6A4SLC5A1SLC5A2PTGER1
SCHEMBL14080145 0.86 SLC5A2 (0.45) SLC5A1SLC5A2PTGER1CYP3A4
SCHEMBL14080134 0.85 PTGER1 (0.39) PPARGPPARASLC5A1SLC5A2PTGER1
SCHEMBL4808336 0.85 SLC5A1 (0.35) SLC6A4SLC5A1SLC5A2
SCHEMBL4808334 0.85 SLC5A1 (0.35) SLC6A4SLC5A1SLC5A2
SCHEMBL14080142 0.84 SLC5A2 (0.41) SLC5A1SLC5A2PTGER1
SCHEMBL4817702 0.83 PTGER1 (0.40) SLC6A4SLC5A1SLC5A2PTGER1CYP1A2
SCHEMBL4817695 0.83 PTGER1 (0.40) SLC6A4SLC5A1SLC5A2PTGER1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414072-B2 Aryl 5-thio-β-d-glucopyranoside derivatives and therapeutic agents for diabetes containing the same TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-08-19 US disclosed
US-7414072-B2 Aryl 5-thio-β-d-glucopyranoside derivatives and therapeutic agents for diabetes containing the same TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-08-19 US disclosed
US-7414072-B2 Aryl 5-thio-β-d-glucopyranoside derivatives and therapeutic agents for diabetes containing the same TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-08-19 US disclosed
US-20050209309-A1 Aryl 5-thio-beta-d-glucopyranoside derivatives and remedies for diabetes containing the same TAISHO PHARMACEUTICAL CO., LTD. 2005-09-22 US disclosed
EP-1528066-A1 ARYL 5-THIO-D-GLUCOPYRANOSIDE DERIVATIVES AND REMEDIES FOR DIABETES CONTAINING THE SAME TAISHO PHARMACEUTICAL CO., LTD (JP) 2005-05-04 EP 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-20050209309-A1 Aryl 5-thio-beta-d-glucopyranoside derivatives and remedies for diabetes containing the same SLC5A2, SLC5A1, UGGT1 HTR2C 2365/4885SLC6A4 156/4885HTR2B 3368/4885

“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.