SCHEMBL7609373

SCHEMBL7609373

CC(C)C[C@H](NC(=O)c1cccs1)C(=O)NCC(=O)CNC(=O)Cc1cccc(-c2ccccn2)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 6/20 0.49
▸ HSPA2 P54652 3/20 0.49
▸ CTSL P07711 6/20 0.48
▸ CTSS P25774 5/20 0.48
▸ CTSB P07858 4/20 0.48
▸ CTSK P43235 7/20 0.45
▸ HSPA9 P38646 2/20 0.41
▸ HSPA1A P0DMV8 1/20 0.41
▸ CTSV O60911 2/20 0.39
▸ HPGD P15428 1/20 0.38
▸ CNR2 P34972 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
SCHEMBL6620163 0.90 HSPA5 (0.49) HSPA5HSPA2CTSLCTSSCTSB
SCHEMBL7463889 0.88 CTSL (0.49) CTSLCTSSCTSBCTSKCTSV
SCHEMBL6927425 0.87 CTSL (0.55) CTSLCTSSCTSBCTSKCTSV
SCHEMBL7467592 0.87 TAS1R3 (0.49) CTSLCTSSCTSBCTSKCNR2
SCHEMBL7806106 0.85 HSPA5 (0.49) HSPA5HSPA2CTSLCTSSCTSB
SCHEMBL7813672 0.85 HSPA5 (0.49) HSPA5HSPA2CTSLCTSSCTSB
SCHEMBL7467469 0.85 CTSL (0.47) CTSLCTSSCTSBCTSKCTSV
SCHEMBL7470718 0.85 CTSL (0.51) CTSLCTSSCTSBCTSKCTSV
SCHEMBL7467318 0.85 CTSL (0.53) CTSLCTSSCTSBCTSKCTSV
SCHEMBL7464820 0.85 CTSL (0.47) CTSLCTSSCTSBCTSKCTSV

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 HSPA5 866/4885HSPA2 1923/4885CTSL 22/4885

“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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