SCHEMBL10981144

SCHEMBL10981144

CC(C)CC(CC=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PSMB1 P20618 1/20 0.52
▸ PSMB5 P28074 1/20 0.52
▸ PSMB2 P49721 1/20 0.52
▸ CTSL P07711 6/20 0.51
▸ CTSK P43235 2/20 0.51
▸ CTSB P07858 4/20 0.51
▸ CAPN1 P07384 2/20 0.51
▸ HTRA1 Q92743 1/20 0.48
▸ PTPN1 P18031 1/20 0.47
▸ REN P00797 1/20 0.47
▸ CTSS P25774 1/20 0.47

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
SCHEMBL10981150 1.00 PSMB1 (0.52) PSMB1PSMB5PSMB2CTSLCTSK
SCHEMBL10636524 0.91 CTSK (0.54) PSMB1PSMB5PSMB2CTSLCTSK
SCHEMBL10980392 0.90 REN (0.54) PSMB1PSMB5PSMB2CTSLCTSK
SCHEMBL10980358 0.90 REN (0.54) PSMB1PSMB5PSMB2CTSLCTSK
SCHEMBL10636541 0.88 CTSL (0.59) PSMB1PSMB5PSMB2CTSLCTSB
SCHEMBL7274809 0.88 CAPN1 (0.60) CTSLCTSKCTSBCAPN1HTRA1
SCHEMBL10978997 0.86 CTSK (0.50) PSMB1PSMB5PSMB2CTSLCTSK
SCHEMBL10978441 0.85 CTSL (0.56) PSMB1PSMB5PSMB2CTSLCTSB
SCHEMBL10976835 0.85 REN (0.56) CTSLCTSBCAPN1REN
SCHEMBL10976837 0.85 REN (0.56) CTSLCTSBCAPN1REN

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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