SCHEMBL23366166

SCHEMBL23366166

O=C(O)CC(NC(=O)[C@H]1C[C@@H](C(=O)C(=O)OCc2ccccc2)C[C@@H](C(=O)C(=O)OCc2ccccc2)C1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 12/20 0.47
CASP3 P42574 3/20 0.45
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
MME P08473 2/20 0.43
ECE1 P42892 1/20 0.43
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL23366221 0.82 PSMB5 (0.36) CASP1CASP3MMEECE1LMNA
SCHEMBL23366189 0.82 PSMB5 (0.36) CASP1CASP3MMEECE1LMNA
SCHEMBL13525028 0.81 MME (0.57) GAAMAPTMMELMNATDP1
SCHEMBL24180261 0.80 PSMB5 (0.34) CASP1CASP3GAAMMEECE1
SCHEMBL22181834 0.79 GAA (0.52) CASP1GAAMAPTMMEECE1
SCHEMBL23366239 0.78 CTSS (0.35)
SCHEMBL23366183 0.77 SMN1; SMN2 (0.52) GAALMNATDP1
SCHEMBL554032 0.76 CASP1 (0.67) CASP1MMEECE1
SCHEMBL376886 0.76 CASP1 (0.67) CASP1MMEECE1
SCHEMBL613386 0.76 CASP1 (0.67) CASP1MMEECE1

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
EP-3377487-B1 COMPOUNDS FOR MEDICINAL APPLICATIONS AusVir Therapeutics Pty Ltd (AU) 2022-01-12 EP disclosed
US-11007274-B2 Compounds for medicinal applications AusVir Therapeutics Pty Ltd (AU) 2021-05-18 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-11007274-B2 Compounds for medicinal applications HAVCR2, ENGASE, DNPEP CASP1 2204/4885CASP3 1240/4885GAA 229/4885

“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.