SCHEMBL17527561

SCHEMBL17527561

CCC(C)OC(=O)CCS(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA3 P07451 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA6 P23280 1/20 0.42
▸ CA5A P35218 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA13 Q8N1Q1 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CA5B Q9Y2D0 1/20 0.42
▸ EPHX2 P34913 1/20 0.40
▸ LMNA P02545 3/20 0.36
▸ MAPK1 P28482 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ TLR2 O60603 1/20 0.30
▸ ENPEP Q07075 4/20 0.30

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
SCHEMBL14566927 0.89 EPHX2 (0.44) CA12CA1CA2CA3CA4
SCHEMBL24282727 0.82 LMNA (0.48) EPHX2LMNAMAPT
SCHEMBL645070 0.81 CA12 (0.45) CA12CA1CA2CA3CA4
SCHEMBL17445925 0.80 CA12 (0.38) CA12CA1CA2CA3CA4
SCHEMBL6128324 0.78 EPHX2 (0.48) EPHX2LMNAMAPT
SCHEMBL1585214 0.77 ALDH1A1 (0.50) CA12CA1CA2CA3CA4
SCHEMBL6231000 0.77 LMNA (0.52) CA12CA1CA2CA3CA4
SCHEMBL2980900 0.77 ALDH1A1 (0.50) CA12CA1CA2CA3CA4
SCHEMBL2989645 0.77 ALDH1A1 (0.50) CA12CA1CA2CA3CA4
SCHEMBL10554751 0.77 LMNA (0.57) CA12CA1CA2CA3CA4

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-20220087967-A1 SULFOPROPANOIC ACID DERIVATIVES FOR TREATING NEURODEGENERATIVE DISORDERS ALZHEON, INC. 2022-03-24 — — US disclosed
EP-2339401-B1 Method of preparing lithographic printing plate FUJIFILM CORP (JP) 2016-02-17 — — 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-20220087967-A1 SULFOPROPANOIC ACID DERIVATIVES FOR TREATING NEURODEGENERATIVE DISORDERS PSEN1, APP, PSEN2 CA12 3184/4885CA1 713/4885CA2 2469/4885

“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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