SCHEMBL7611780

SCHEMBL7611780

CC(C)C[C@H](NC(=O)c1ccc2ocnc2c1)C(=O)NCC(=O)CNC(=O)Cc1cccc(-c2ccccn2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 11/20 0.46
▸ CTSB P07858 5/20 0.46
▸ CTSS P25774 5/20 0.46
▸ CTSK P43235 8/20 0.44
▸ CTSV O60911 2/20 0.38
▸ TAS1R3 Q7RTX0 2/20 0.37
▸ TAS1R1 Q7RTX1 2/20 0.37
▸ CTNNB1 P35222 1/20 0.36
▸ WNT3A P56704 1/20 0.36
▸ NAMPT P43490 1/20 0.35

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
SCHEMBL6927425 0.88 CTSL (0.55) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7813767 0.87 CTSL (0.43) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7462272 0.86 CTSL (0.50) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7473345 0.86 TAS1R3 (0.54) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7473976 0.86 CTSL (0.49) CTSLCTSBCTSSCTSKCTSV
SCHEMBL6927525 0.86 CTSL (0.49) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7467318 0.85 CTSL (0.53) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7461611 0.84 CTSL (0.47) CTSLCTSBCTSSCTSKCTSV
SCHEMBL7466927 0.84 CTSL (0.48) CTSLCTSBCTSSCTSKTAS1R3
SCHEMBL7470718 0.84 CTSL (0.51) CTSLCTSBCTSSCTSKCTSV

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-20020156018-A1 Treatment of parasitic diseases by inhibition of cysteine proteases of the papain superfamily THOMPSON SCOTT KEVIN (US) 2002-10-24 — — US claimed
US-20020156018-A1 Treatment of parasitic diseases by inhibition of cysteine proteases of the papain superfamily THOMPSON SCOTT KEVIN (US) 2002-10-24 — — 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-20020156018-A1 Treatment of parasitic diseases by inhibition of cysteine proteases of the papain superfamily PEPD, PREP, CPN1 CTSL 22/4885CTSB 35/4885CTSS 4/4885

“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.

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