SCHEMBL10976835

SCHEMBL10976835

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

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 10/20 0.56
▸ CTSL P07711 2/20 0.47
▸ CAPN1 P07384 2/20 0.47
▸ CTSB P07858 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
SCHEMBL10976837 1.00 REN (0.56) RENCTSLCAPN1CTSB
SCHEMBL10977797 0.90 REN (0.57) RENCTSLCAPN1CTSB
SCHEMBL10977795 0.90 REN (0.57) RENCTSLCAPN1CTSB
SCHEMBL10980046 0.90 REN (0.60) RENCTSLCAPN1CTSB
SCHEMBL10981774 0.90 REN (0.60) RENCTSLCAPN1CTSB
SCHEMBL10980049 0.90 REN (0.60) RENCTSLCAPN1CTSB
SCHEMBL10981144 0.85 PSMB1 (0.52) RENCTSLCAPN1CTSB
SCHEMBL10981150 0.85 PSMB1 (0.52) RENCTSLCAPN1CTSB
SCHEMBL10636541 0.84 CTSL (0.59) CTSLCAPN1CTSB
SCHEMBL7274809 0.84 CAPN1 (0.60) CTSLCAPN1CTSB

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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