SCHEMBL25097139

SCHEMBL25097139

C[C@H](NC(=O)C(=O)Nc1c(F)cccc1F)C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)COc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 15/20 0.44
▸ CASP6 P55212 14/20 0.44
▸ CASP8 Q14790 14/20 0.44
▸ PTPN1 P18031 5/20 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
SCHEMBL22390688 0.89 CASP3 (0.50) CASP3CASP6CASP8
SCHEMBL22390689 0.89 CASP3 (0.50) CASP3CASP6CASP8
SCHEMBL22390623 0.86 CASP3 (0.60) CASP3CASP6CASP8
SCHEMBL22390624 0.86 CASP3 (0.60) CASP3CASP6CASP8
SCHEMBL30220140 0.84 CASP3 (0.51) CASP3CASP6CASP8PTPN1
SCHEMBL22404781 0.84 CASP3 (0.51) CASP3CASP6CASP8PTPN1
SCHEMBL22404815 0.78 KLK7 (0.46) PTPN1
SCHEMBL22404789 0.76 CASP3 (0.42) CASP3CASP6CASP8
SCHEMBL22390758 0.76 CASP3 (0.59) CASP3CASP6CASP8
SCHEMBL25985480 0.75 CASP3 (0.59) CASP3CASP6CASP8

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 6 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-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-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 CASP3 2/4885CASP6 8/4885CASP8 9/4885
US-12071412-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CASP3 2/4885CASP6 8/4885CASP8 9/4885
US-11597703-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CASP3 2/4885CASP6 8/4885CASP8 9/4885

“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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