SCHEMBL10722533

SCHEMBL10722533

CC(C)CC(NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)C(C=O)CC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 8/20 0.57
▸ CASP3 P42574 1/20 0.48
▸ CTSB P07858 2/20 0.47
▸ CTSK P43235 1/20 0.47
▸ CTSD P07339 1/20 0.44
▸ CASP1 P29466 1/20 0.42
▸ NMBR P28336 1/20 0.42
▸ CTSL P07711 3/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP8 P22894 1/20 0.42
▸ PSMB1 P20618 1/20 0.41

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
SCHEMBL10722540 1.00 REN (0.57) RENCASP3CTSBCTSKCTSD
SCHEMBL10721003 1.00 REN (0.57) RENCASP3CTSBCTSKCTSD
SCHEMBL10721009 1.00 REN (0.57) RENCASP3CTSBCTSKCTSD
SCHEMBL10722889 1.00 REN (0.57) RENCASP3CTSBCTSKCTSD
SCHEMBL10724214 0.93 REN (0.55) RENCASP3CTSBCTSKCTSD
SCHEMBL10724217 0.93 REN (0.55) RENCASP3CTSBCTSKCTSD
SCHEMBL10721169 0.93 REN (0.55) RENCASP3CTSBCTSKCTSD
SCHEMBL10721180 0.93 REN (0.55) RENCASP3CTSBCTSKCTSD
SCHEMBL10722735 0.93 REN (0.55) RENCASP3CTSBCTSKCTSD
SCHEMBL10722144 0.92 REN (0.64) RENCASP3CTSBCTSKCTSD

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-4698329-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1987-10-06 — — US disclosed
EP-0152255-A2 New renin-inhibitory peptides and their use SANKYO COMPANY LIMITED (JP) 1985-08-21 — — EP disclosed
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