SCHEMBL5843343

SCHEMBL5843343

CCN(Nc1ccc(OC)cc1)C(=O)C(CC1CCCCC1)NC(=O)c1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 15/20 0.50
CTSL P07711 10/20 0.50
CTSK P43235 6/20 0.50
USP30 Q70CQ3 1/20 0.44
EPHX2 P34913 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
SLC6A9 P48067 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
SCHEMBL5841162 0.91 CTSS (0.53) CTSSCTSLCTSKUSP30
SCHEMBL5842862 0.90 CTSS (0.52) CTSSCTSLCTSKUSP30
SCHEMBL5842009 0.87 CTSS (0.57) CTSSCTSLCTSKEPHX2TAS1R3
SCHEMBL5844353 0.86 CTSS (0.55) CTSSCTSLCTSKUSP30
SCHEMBL5841716 0.86 CTSS (0.46) CTSSCTSLCTSKUSP30SLC6A9
SCHEMBL5842618 0.86 CTSS (0.48) CTSSCTSLCTSKUSP30EPHX2
SCHEMBL5842678 0.85 CTSS (0.51) CTSSCTSLCTSKEPHX2
SCHEMBL5842643 0.84 GRN (0.55) CTSSCTSLCTSKEPHX2
SCHEMBL5843557 0.84 CTSS (0.48) CTSSCTSLCTSKUSP30EPHX2
SCHEMBL5844306 0.84 CTSS (0.45) CTSSCTSLCTSKUSP30TAS1R3

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
US-7109243-B2 Inhibitors of cathepsin S IRM LLC (BM) 2006-09-19 US claimed
US-7109243-B2 Inhibitors of cathepsin S IRM LLC (BM) 2006-09-19 US disclosed
WO-2004084842-A2 INHIBITORS OF CATHEPSIN S IRM LLC (BM) 2004-10-07 WO disclosed
US-20040198780-A1 Inhibitors of cathepsin S IRM LLC (BM) 2004-10-07 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 (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-20040198780-A1 Inhibitors of cathepsin S CTSS, CTSK, CTSE CTSS 1/4885CTSL 10/4885CTSK 2/4885

“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.