SCHEMBL4817702

SCHEMBL4817702

OC[C@@H]1S[C@H](Oc2ccc(Cl)cc2Cc2ccccc2F)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 6/20 0.40
SLC5A1 P13866 5/20 0.38
SLC5A2 P31639 5/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PKM P14618 1/20 0.37
ATM Q13315 1/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
KCNH2 Q12809 1/20 0.36
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 2/20 0.32

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
SCHEMBL4817695 1.00 PTGER1 (0.40) PTGER1SLC5A1SLC5A2FNTAFNTB
SCHEMBL4815023 0.89 PTGER1 (0.41) PTGER1SLC5A1SLC5A2CYP1A2CYP2C9
SCHEMBL4815015 0.89 PTGER1 (0.41) PTGER1SLC5A1SLC5A2CYP1A2CYP2C9
SCHEMBL4805370 0.87 SLC5A1 (0.40) SLC5A1SLC5A2SLC6A2SLC6A4SLC6A3
SCHEMBL4805362 0.87 SLC5A1 (0.40) SLC5A1SLC5A2SLC6A2SLC6A4SLC6A3
SCHEMBL14080145 0.87 SLC5A2 (0.45) PTGER1SLC5A1SLC5A2MEN1KMT2A
SCHEMBL4817939 0.86 PTGER1 (0.35) PTGER1SLC5A1SLC5A2FNTAFNTB
SCHEMBL4817946 0.86 PTGER1 (0.35) PTGER1SLC5A1SLC5A2FNTAFNTB
SCHEMBL14080139 0.85 CYP2C19 (0.40) PTGER1SLC5A1SLC5A2MEN1KMT2A
SCHEMBL4807926 0.84 SLC5A2 (0.36) PTGER1SLC5A1SLC5A2CYP1A2CYP2C9

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-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 PTGER1 3048/4885SLC5A1 2/4885SLC5A2 1/4885

“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.