SCHEMBL10985008

SCHEMBL10985008

COC(=O)C[C@H](CC(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 8/20 0.58
▸ CAPN1 P07384 2/20 0.55
▸ CTSS P25774 2/20 0.55
▸ CTSL P07711 1/20 0.55
▸ CTSB P07858 1/20 0.55
▸ CTRB1 P17538 2/20 0.54
▸ REN P00797 1/20 0.54
▸ PSMB1 P20618 1/20 0.53
▸ PSMB5 P28074 1/20 0.53
▸ PSMB2 P49721 1/20 0.53

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
SCHEMBL10985006 1.00 CTSK (0.58) CTSKCAPN1CTSSCTSLCTSB
SCHEMBL10966776 0.90 CTRB1 (0.61) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL25182274 0.89 CTSK (0.61) CTSKCAPN1CTSSCTSLCTSB
SCHEMBL8881595 0.87 PSMB1 (0.59) CTSKCAPN1CTSSCTSLCTSB
SCHEMBL79250 0.86 CTRB1 (0.57) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL14530318 0.86 SYK (0.60) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL10964829 0.86 CTRB1 (0.57) CTRB1
SCHEMBL555191 0.86 CTRB1 (0.57) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL28184491 0.86 CTRB1 (0.68) CTSKCAPN1CTSSCTSLCTSB
SCHEMBL555192 0.86 CTRB1 (0.57) CTSKCTSSCTSLCTSBCTRB1

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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