SCHEMBL3948274

SCHEMBL3948274

C[C@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)ccc2Cl)CN1C#N

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 4/20 0.62
CTSS P25774 4/20 0.62
CTSK P43235 4/20 0.62
CTSC P53634 4/20 0.62
ACHE P22303 1/20 0.43
HTT P42858 3/20 0.40
TSHR P16473 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MCL1 Q07820 3/20 0.40
HPGD P15428 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
HTR6 P50406 1/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL3948958 1.00 CTSL (0.62) CTSLCTSSCTSKCTSCACHE
SCHEMBL3945737 0.87 CTSL (0.79) CTSLCTSSCTSKCTSCTSHR
SCHEMBL3948954 0.86 CTSL (0.46) CTSLCTSSCTSKCTSCACHE
SCHEMBL3946787 0.86 CTSL (0.57) CTSLCTSSCTSKCTSCTSHR
SCHEMBL4302072 0.85 CTSL (0.46) CTSLCTSSCTSKCTSCACHE
SCHEMBL4295377 0.83 CTSL (0.43) CTSLCTSSCTSKCTSCACHE
SCHEMBL4046173 0.83 CTSL (0.46) CTSLCTSSCTSKCTSCTSHR
SCHEMBL4046167 0.83 CTSL (0.46) CTSLCTSSCTSKCTSCTSHR
SCHEMBL4298878 0.83 CTSL (0.58) CTSLCTSSCTSKCTSCALDH1A1
SCHEMBL3948813 0.81 ACHE (0.43) CTSLCTSSCTSKCTSCACHE

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
US-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-10-22 US claimed
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 WO claimed
US-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-10-22 US disclosed
US-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-10-22 US disclosed
US-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-10-22 US disclosed
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 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-20090264431-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE CTSB, CTSS, CTSF CTSL 7/4885CTSS 2/4885CTSK 12/4885

“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.