SCHEMBL21645296

SCHEMBL21645296

CC(C)(F)CC(NC(c1ccc(-c2ccc(C(O)C(F)F)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 15/20 1.00
CTSL P07711 5/20 0.75
CTSB P07858 2/20 0.75
CTSF Q9UBX1 2/20 0.75
CTSV O60911 1/20 0.75
CTSS P25774 1/20 0.75

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
SCHEMBL23874957 1.00 CTSK (1.00) CTSKCTSLCTSBCTSFCTSV
SCHEMBL4987203 1.00 CTSK (1.00) CTSKCTSLCTSBCTSFCTSV
SCHEMBL4590757 1.00 CTSK (1.00) CTSKCTSLCTSBCTSFCTSV
SCHEMBL4590785 1.00 CTSK (1.00) CTSKCTSLCTSBCTSFCTSV
SCHEMBL5742250 0.91 CTSK (0.85) CTSKCTSLCTSBCTSFCTSV
SCHEMBL4986789 0.90 CTSK (0.82) CTSKCTSLCTSBCTSFCTSV
SCHEMBL2155710 0.90 CTSK (0.82) CTSKCTSLCTSBCTSFCTSV
SCHEMBL21690159 0.90 CTSK (0.82) CTSKCTSLCTSBCTSFCTSV
SCHEMBL2155451 0.90 CTSK (0.82) CTSKCTSLCTSBCTSFCTSV
SCHEMBL23875152 0.90 CTSK (0.82) CTSKCTSLCTSBCTSFCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317077-A1 Crystalline Forms of N1-(1-Cyanocycloproply)-N2-((1S)-1-{4'-[(1R-2,2-Difluoro-1-Hydroxyethyl]Biphenyl-4-YL}-2,2,2-Trifluoroethyl)-4-Fluoro-L-Leucinamide INTERVET INC. (US) 2021-10-14 US disclosed
US-20210300863-A1 PROCESS TO MAKE A SELECTIVE CATHEPSIN CYSTEINE PROTEASE INHIBITOR INTERVET INC. (US) 2021-09-30 US disclosed
US-20210300863-A1 PROCESS TO MAKE A SELECTIVE CATHEPSIN CYSTEINE PROTEASE INHIBITOR INTERVET INC. (US) 2021-09-30 US disclosed
EP-3830075-A1 CRYSTALLINE FORMS OF N1-(1-CYANOCYCLOPROPLY)-N2-((1S)-1-{4'-[(1R-2,2-DIFLUORO-1-HYDROXYETHYL]BIPHENYL-4-YL}-2,2,2-TRIFLUOROETHYL)-4-FLUORO-L-LEUCINAMIDE Intervet International B.V. (NL) 2021-06-09 EP disclosed
EP-3830074-A1 PROCESS TO MAKE A SELECTIVE CATHEPSIN CYSTEINE PROTEASE INHIBITOR Intervet International B.V. (NL) 2021-06-09 EP disclosed
WO-2020025748-A1 PROCESS TO MAKE A SELECTIVE CATHEPSIN CYSTEINE PROTEASE INHIBITOR INTERVET INTERNATIONAL B.V. (NL) 2020-02-06 WO disclosed
WO-2020025748-A1 PROCESS TO MAKE A SELECTIVE CATHEPSIN CYSTEINE PROTEASE INHIBITOR INTERVET INTERNATIONAL B.V. (NL) 2020-02-06 WO disclosed
WO-2020025749-A1 CRYSTALLINE FORMS OF N1-(1-CYANOCYCLOPROPLY)-N2-((1S)-1-{4'-[(1R-2,2-DIFLUORO-1-HYDROXYETHYL]BIPHENYL-4-YL}-2,2,2-TRIFLUOROETHYL)-4-FLUORO-L-LEUCINAMIDE INTERVET INTERNATIONAL B.V. (NL) 2020-02-06 WO 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-20210300863-A1 PROCESS TO MAKE A SELECTIVE CATHEPSIN CYSTEINE PROTEASE INHIBITOR CTSB, CTSF, CTSZ CTSK 8/4885CTSL 11/4885CTSB 1/4885

“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.