SCHEMBL10978441

SCHEMBL10978441

CC(C)C[C@@H](C=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 8/20 0.56
▸ CTSB P07858 7/20 0.56
▸ PSMB1 P20618 1/20 0.53
▸ PSMB5 P28074 1/20 0.53
▸ PSMB2 P49721 1/20 0.53
▸ CTSS P25774 3/20 0.50
▸ CASP3 P42574 1/20 0.49
▸ CASP7 P55210 1/20 0.49
▸ CAPN1 P07384 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
SCHEMBL10636541 0.97 CTSL (0.59) CTSLCTSBPSMB1PSMB5PSMB2
SCHEMBL10984447 0.91 CTSL (0.53) CTSLCTSBPSMB1PSMB5PSMB2
SCHEMBL10633448 0.87 REN (0.56) CTSLCTSBPSMB1PSMB5PSMB2
SCHEMBL7274809 0.86 CAPN1 (0.60) CTSLCTSBCAPN1
SCHEMBL10521374 0.86 CAPN1 (0.48) CTSLCTSBPSMB1PSMB5PSMB2
SCHEMBL10981376 0.86 NMBR (0.60) PSMB5CASP3CASP7
SCHEMBL10981144 0.85 PSMB1 (0.52) CTSLCTSBPSMB1PSMB5PSMB2
SCHEMBL10981150 0.85 PSMB1 (0.52) CTSLCTSBPSMB1PSMB5PSMB2
SCHEMBL7030418 0.85 CTSL (0.50) CTSLCTSBCTSS
SCHEMBL1661198 0.84 CTSL (0.57) CTSLCTSBCTSS

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-4548926-A RENIN INHIBITOR SANKYO COMPANY LIMITED (JP) 1985-10-22 — — US disclosed
EP-0128762-A2 New hypotensive peptides, their preparation and their use SANKYO COMPANY LIMITED (JP) 1984-12-19 — — EP disclosed
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