SCHEMBL8260299

SCHEMBL8260299

CC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(/C=C/S(C)(=O)=O)Cc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 6/20 0.71
CTSB P07858 3/20 0.71
PSMB5 P28074 5/20 0.66
PSMB2 P49721 2/20 0.63
CASP3 P42574 2/20 0.62
CASP7 P55210 1/20 0.61
CAPN1 P07384 1/20 0.61
PSMB1 P20618 1/20 0.60
PSMB8 P28062 1/20 0.60
PSMB10 P40306 1/20 0.60

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
SCHEMBL8259042 0.99 CTSL (0.70) CTSLCTSBPSMB5PSMB2CASP3
SCHEMBL30490629 0.94 PSMB5 (0.73) CTSLCTSBPSMB5PSMB2CASP3
SCHEMBL8261586 0.92 CASP3 (0.68) CTSLCTSBCASP3CASP7
SCHEMBL8260998 0.89 CTSL (0.69) CTSLCTSBPSMB5CASP3CASP7
SCHEMBL8259747 0.88 CTSL (0.68) CTSLCTSBCASP3CASP7
SCHEMBL19944919 0.88 CASP3 (0.70) CTSLCTSBPSMB5CASP3CASP7
SCHEMBL8260989 0.88 CASP3 (0.67) CTSLCTSBPSMB5CASP3CASP7
SCHEMBL11998316 0.87 PSMB5 (0.68) CTSLCTSBPSMB5CASP3CASP7
SCHEMBL7353898 0.86 CTSL (0.76) CTSLCTSBCASP3CASP7CAPN1
SCHEMBL7353893 0.86 CTSL (0.76) CTSLCTSBCASP3CASP7CAPN1

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-7589066-B2 Such as N-carbobenzyloxy-phenylalanyl-phenylalanylal; for treating cancer, inflammation, and/or autoimmune diseases; suppresses endogenous antigenic peptide generation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2009-09-15 US disclosed
US-7589066-B2 Such as N-carbobenzyloxy-phenylalanyl-phenylalanylal; for treating cancer, inflammation, and/or autoimmune diseases; suppresses endogenous antigenic peptide generation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2009-09-15 US disclosed
WO-2006099261-A2 POTENT AND SPECIFIC IMMUNOPROTEASOME INHIBITORS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2006-09-21 WO disclosed