SCHEMBL30220182

SCHEMBL30220182

CC(C)(C)OC(=O)N[C@@H](CCOCc1ccsc1)C(=O)COc1c(F)c(F)cc(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 3/20 0.44
▸ CTSS P25774 2/20 0.44
▸ CTSV O60911 1/20 0.40
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ CTSH P09668 1/20 0.40
▸ CTSF Q9UBX1 1/20 0.40
▸ PPARA Q07869 2/20 0.39
▸ CASP3 P42574 13/20 0.38
▸ CASP6 P55212 9/20 0.38
▸ CASP8 Q14790 9/20 0.38
▸ PPARG P37231 1/20 0.38
▸ CASP7 P55210 1/20 0.36
▸ PTPN1 P18031 1/20 0.36

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
SCHEMBL22404792 0.88 PPARA (0.52) CTSSPPARACASP3CASP6CASP8
SCHEMBL22390774 0.87 CTSV (0.43) CTSKCTSSCTSVCTSLCTSB
SCHEMBL22390779 0.87 CTSV (0.43) CTSKCTSSCTSVCTSLCTSB
SCHEMBL30220135 0.86 CACNA1B (0.44) CTSKCTSSCTSVCTSLCTSB
SCHEMBL22404750 0.82 CTSK (0.47) CTSKCTSSCTSVCTSLCTSB
SCHEMBL30220129 0.81 CTSK (0.52) CTSKCTSSCTSLCTSBPPARA
SCHEMBL22390651 0.80 CTSS (0.57) CTSKCTSSCTSLCTSBPPARA
SCHEMBL22390650 0.80 CTSS (0.57) CTSKCTSSCTSLCTSBPPARA
SCHEMBL22390723 0.79 CTSS (0.53) CTSKCTSSCTSLCTSBPPARA
SCHEMBL22390724 0.79 CTSS (0.53) CTSKCTSSCTSLCTSBPPARA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3935042-B1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC (KR) 2024-08-28 — — EP disclosed
US-12071412-B2 Caspase inhibitors and methods of use thereof NOBO MEDICINE INC. (KR) 2024-08-27 — — US disclosed
US-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC. (KR) 2023-08-10 — — US disclosed
US-11597703-B2 Caspase inhibitors and methods of use thereof HISTOGEN, INC. (US) 2023-03-07 — — 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 (3 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-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF CASP1, CASP3, CASP7 CTSK 68/4885CTSS 66/4885CTSV 86/4885
US-12071412-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CTSK 68/4885CTSS 66/4885CTSV 86/4885
US-11597703-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CTSK 68/4885CTSS 66/4885CTSV 86/4885

“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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