SCHEMBL22390779

SCHEMBL22390779

O=C(O)NC(CCOCc1ccsc1)C(=O)COc1c(F)c(F)cc(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSV O60911 1/20 0.43
▸ CTSL P07711 1/20 0.43
▸ CTSB P07858 1/20 0.43
▸ CTSH P09668 1/20 0.43
▸ CTSS P25774 1/20 0.43
▸ CTSK P43235 1/20 0.43
▸ CTSF Q9UBX1 1/20 0.43
▸ CASP3 P42574 19/20 0.41
▸ CASP8 Q14790 13/20 0.41
▸ CASP6 P55212 11/20 0.41
▸ CASP1 P29466 2/20 0.40
▸ CASP9 P55211 2/20 0.40
▸ CASP7 P55210 1/20 0.39

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
SCHEMBL22390774 1.00 CTSV (0.43) CTSVCTSLCTSBCTSHCTSS
SCHEMBL22390737 0.88 CASP3 (0.49) CTSVCTSLCTSBCTSHCTSS
SCHEMBL22390740 0.88 CASP3 (0.49) CTSVCTSLCTSBCTSHCTSS
SCHEMBL30220182 0.87 CTSK (0.44) CTSVCTSLCTSBCTSHCTSS
SCHEMBL22390629 0.85 CASP3 (0.47) CTSVCTSLCTSBCTSHCTSS
SCHEMBL22390630 0.85 CASP3 (0.47) CTSVCTSLCTSBCTSHCTSS
Hydrochloric Acid SCHEMBL22390746 0.82 SLC1A3 (0.39) CTSVCTSLCTSBCTSHCTSS
Hydrochloric Acid SCHEMBL22390744 0.82 SLC1A3 (0.38) CTSVCTSLCTSBCTSHCTSS
SCHEMBL22390649 0.78 CTSK (0.51) CTSVCTSLCTSBCTSHCTSS
SCHEMBL22390748 0.78 SLC1A3 (0.41) CTSSCTSK

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-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
US-20200283396-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC. (KR) 2020-09-10 — — 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 CTSV 86/4885CTSL 33/4885CTSB 34/4885
US-20200283396-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF CASP1, CASP3, CASP7 CTSV 86/4885CTSL 33/4885CTSB 34/4885
US-11597703-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CTSV 86/4885CTSL 33/4885CTSB 34/4885

“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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