SCHEMBL5841970

SCHEMBL5841970

CCN(Nc1ccc(OC)cc1)C(=O)C(Cc1ccccc1)NC(=O)c1cc(C)c(C)cc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.47
CTSL P07711 3/20 0.45
CTSS P25774 3/20 0.45
CTSK P43235 1/20 0.45
PYGL P06737 1/20 0.45
PIN1 Q13526 1/20 0.43
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
NPC1 O15118 1/20 0.43
ITGB1 P05556 2/20 0.42
ITGA4 P13612 2/20 0.42
HDAC3 O15379 2/20 0.41
HDAC4 P56524 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC10 Q969S8 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41

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
SCHEMBL5843469 0.86 ITGB1 (0.51) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5843064 0.86 CTSL (0.49) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5841984 0.85 CTSL (0.49) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5843867 0.84 GPR139 (0.58) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5843221 0.83 PTPN1 (0.48) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5843966 0.82 CTSL (0.53) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5844560 0.82 USP30 (0.50) FPR2CTSLCTSSCTSKPYGL
SCHEMBL5843744 0.80 CTSL (0.66) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL5843011 0.80 CTSL (0.64) CTSLCTSSCTSK
SCHEMBL5842335 0.80 USP30 (0.53) FPR2CTSLCTSSCTSKGAA

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 2 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 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 FPR2 1311/4885CTSL 10/4885CTSS 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.