SCHEMBL21669233

SCHEMBL21669233

CCOC(O)C(NC(=O)OCc1ccccc1)c1ccc(OC(=O)CCS(=O)(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
ACHE P22303 2/20 0.43
ATM Q13315 1/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
TOP2A P11388 1/20 0.39
TOP2B Q02880 1/20 0.39
KLK1 P06870 1/20 0.38
MMP13 P45452 1/20 0.37
ELANE P08246 1/20 0.37
LMNA P02545 3/20 0.37
CYP3A4 P08684 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL24282829 0.91 CA1 (0.43) CA1CA2ACHEATMCTSL
SCHEMBL21669244 0.91 CA1 (0.44) CA1CA2ACHEATMCTSL
SCHEMBL21669240 0.88 CA1 (0.42) CA1CA2ACHEATMCTSL
SCHEMBL24282891 0.86 TRPM8 (0.44) ATMCTSLCTSSTOP2ATOP2B
SCHEMBL21669352 0.83 KMT2A (0.41) ELANELMNACYP3A4MEN1KMT2A
SCHEMBL21669232 0.83 PPARG (0.39) CA1CA2CTSSMMP13ELANE
SCHEMBL21669236 0.82 CA1 (0.43) CA1CA2ACHEATMCTSL
SCHEMBL21669256 0.80 CA1 (0.45) CA1CA2ACHEATMCTSL
SCHEMBL24283208 0.79 TRPM8 (0.48) ATMCTSLCTSS
SCHEMBL21669296 0.78 KMT2A (0.38) ELANELMNAMEN1KMT2A

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
EP-3829568-B1 SULFOPROPANOIC ACID DERIVATIVES FOR TREATING NEURODEGENERATIVE DISORDERS ALZHEON INC (US) 2023-09-06 EP disclosed
US-20220087967-A1 SULFOPROPANOIC ACID DERIVATIVES FOR TREATING NEURODEGENERATIVE DISORDERS ALZHEON, INC. 2022-03-24 US disclosed
WO-2020028348-A1 SULFOPROPANOIC ACID DERIVATIVES FOR TREATING NEURODEGENERATIVE DISORDERS ALZHEON, INC. (US) 2020-02-06 WO 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 CA1 713/4885CA2 2469/4885ACHE 317/4885

“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.