SCHEMBL20204723

SCHEMBL20204723

CC(C)C[C@H](NC(=O)O)C(=O)N[C@H](C=O)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSB P07858 4/20 0.63
CTSL P07711 3/20 0.53
PSMB5 P28074 2/20 0.53
PSMB2 P49721 2/20 0.53
PSMB1 P20618 1/20 0.53
CMA1 P23946 1/20 0.52
CTRC Q99895 1/20 0.52
MME P08473 2/20 0.52
ANPEP P15144 1/20 0.49

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
SCHEMBL5572956 1.00 CTSB (0.63) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL20204725 1.00 CTSB (0.63) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL7144589 0.90 CTSB (0.61) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL13706577 0.90 CTSB (0.61) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL8259852 0.88 CTSB (0.62) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL13933704 0.88 CTSB (0.62) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL24178168 0.88 CTSB (0.58) CTSBCTSLPSMB5PSMB2CMA1
SCHEMBL30371890 0.88 CTSB (0.58) CTSBCTSLPSMB5PSMB2PSMB1
SCHEMBL24178174 0.88 CTSB (0.58) CTSBCTSLPSMB5PSMB2CMA1
SCHEMBL20204721 0.88 CTSB (0.55) CTSBCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124498-B2 Compositions and methods for modulating protease activity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-09-21 US disclosed
US-20200048227-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-13 US disclosed
WO-2018097999-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-31 WO 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 (2 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-11124498-B2 Compositions and methods for modulating protease activity RNASE1, ADAM8, CTRL CTSB 8/4885CTSL 34/4885PSMB5 518/4885
US-20200048227-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY RNASE1, ADAM8, CTRL CTSB 8/4885CTSL 34/4885PSMB5 518/4885

“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.