SCHEMBL20052370

SCHEMBL20052370

CC(C)C(NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](/C=C/S(C)(=O)=O)CC(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 13/20 0.61
CASP7 P55210 8/20 0.61
CASP1 P29466 7/20 0.59
CASP9 P55211 2/20 0.58
PSMB5 P28074 2/20 0.49
REN P00797 2/20 0.49
CASP4 P49662 1/20 0.48
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46

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
SCHEMBL15462621 1.00 CASP3 (0.61) CASP3CASP7CASP1CASP9PSMB5
SCHEMBL30008729 0.82 CASP1 (0.59) CASP3CASP7CASP1CASP9REN
SCHEMBL15906082 0.80 CASP3 (0.71) CASP3CASP7CASP1CASP9PSMB5
SCHEMBL9961962 0.80 CASP3 (0.72) CASP3CASP7CASP1CASP9PSMB5
SCHEMBL15462710 0.79 CTSS (0.62) CASP3CASP7CASP1RENCTSS
SCHEMBL20052391 0.79 CTSS (0.62) CASP3CASP7CASP1RENCTSS
SCHEMBL18471566 0.79 CASP1 (0.74) CASP3CASP7CASP1CASP9PSMB5
SCHEMBL7969952 0.79 CASP1 (0.74) CASP3CASP7CASP1CASP9PSMB5
SCHEMBL15906084 0.78 CASP3 (0.70) CASP3CASP7CASP1CASP9PSMB5
SCHEMBL7888485 0.76 CASP3 (0.79) CASP3CASP7CASP1CASP9PSMB5

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-10975119-B2 Selective cysteine protease inhibitors and uses thereof GENESIS TECHNOLOGIES LIMITED (BB) 2021-04-13 US disclosed
US-20180186833-A1 SELECTIVE CYSTEINE PROTEASE INHIBITORS AND USES THEREOF GENESIS TECH LIMITED (BB) 2018-07-05 US disclosed
US-9944674-B2 Selective cysteine protease inhibitors and uses thereof GENESIS TECHNOLOGIES LIMITED (BB) 2018-04-17 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 (2 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-20180186833-A1 SELECTIVE CYSTEINE PROTEASE INHIBITORS AND USES THEREOF SERPINB1, SERPINE1, CASP5 CASP3 146/4885CASP7 102/4885CASP1 25/4885
US-10975119-B2 Selective cysteine protease inhibitors and uses thereof SERPINB1, SERPINE1, CASP5 CASP3 171/4885CASP7 129/4885CASP1 29/4885

“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.