SCHEMBL6808023

SCHEMBL6808023

CC(C)CC(NC(=O)OCc1ccccc1)C(=O)c1nnc(SCCN(C)C)o1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.49
CTSB P07858 5/20 0.49
CTSK P43235 12/20 0.49
CTSS P25774 5/20 0.48
ATM Q13315 1/20 0.46
CAPN1 P07384 1/20 0.44

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
Hydrochloric Acid SCHEMBL6809074 0.99 CTSL (0.49) CTSLCTSBCTSKCTSSATM
SCHEMBL5497649 0.97 CTSK (0.51) CTSLCTSBCTSKCTSSCAPN1
SCHEMBL6812919 0.87 CTSK (0.48) CTSLCTSBCTSKCTSSCAPN1
Hydrochloric Acid SCHEMBL6808070 0.86 CTSK (0.47) CTSLCTSBCTSKCTSSCAPN1
SCHEMBL5495744 0.85 CTSK (0.55) CTSLCTSBCTSKCTSSCAPN1
SCHEMBL5496377 0.83 CTSK (0.57) CTSLCTSBCTSKCTSSCAPN1
SCHEMBL5492843 0.82 CTSK (0.56) CTSLCTSBCTSKCTSSCAPN1
SCHEMBL6808872 0.81 TSHR (0.52) CTSKCTSS
SCHEMBL6808450 0.81 SMN1; SMN2 (0.39) CTSK
Hydrochloric Acid SCHEMBL6809032 0.81 TSHR (0.51) CTSLCTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040204368-A1 Oxadiazole derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-10-14 US claimed

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-20040204368-A1 Oxadiazole derivative compounds and drugs containing these compounds as the active ingredient ACIN1, CASP3, CASP7 CTSL 263/4885CTSB 465/4885CTSK 451/4885

“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.