SCHEMBL6478045

SCHEMBL6478045

Cc1ccc(S(=O)(=O)CCOC(=O)COc2cc(S(=O)(=O)Cl)ccc2OC(CCS(=O)(=O)c2ccc(C)cc2)C(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.39
LMNA P02545 2/20 0.36
ALDH1A1 P00352 6/20 0.36
HTT P42858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GAA P10253 2/20 0.35
PAX8 Q06710 1/20 0.35
KMT2A Q03164 2/20 0.35
PLA2G2C Q5R387 1/20 0.34
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5361897 0.87 KMT2A (0.43) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL5760942 0.84 KMT2A (0.45) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL5761411 0.80 ALDH1A1 (0.38) PTGDR2LMNAALDH1A1HTTKDM4E
SCHEMBL5760908 0.79 GAA (0.43) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL3391374 0.75 PPARG (0.48) LMNAALDH1A1HTTGAAKMT2A
SCHEMBL3391356 0.75 GAA (0.52) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL5763384 0.74 LMNA (0.52) LMNAALDH1A1GAAKMT2A
SCHEMBL5762956 0.72 KMT2A (0.44) LMNAALDH1A1HTTKDM4EHPGD
SCHEMBL5761722 0.71 GAA (0.56) LMNAALDH1A1GAAKMT2A
SCHEMBL5761990 0.71 KMT2A (0.50) LMNAALDH1A1HTTKDM4EHPGD

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-6897227-B2 Prodrugs of proton pump inhibitors Winston Pharmaceuticals, Inc. (US) 2005-05-24 US disclosed
US-20040102484-A1 Prodrugs of proton pump inhibitors ALEVIUM PHARMACEUTICALS, INC. 2004-05-27 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-20040102484-A1 Prodrugs of proton pump inhibitors ABCB11, SLC10A2, SI PTGDR2 662/4885LMNA 4395/4885ALDH1A1 397/4885

“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.