SCHEMBL11016992

SCHEMBL11016992

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

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 19/20 0.59
▸ CTSB P07858 1/20 0.47
▸ CTSK P43235 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
SCHEMBL11016810 1.00 REN (0.59) RENCTSBCTSK
SCHEMBL11014146 1.00 REN (0.59) RENCTSBCTSK
SCHEMBL11015610 1.00 REN (0.59) RENCTSBCTSK
SCHEMBL10720568 0.95 REN (0.60) RENCTSBCTSK
SCHEMBL10720578 0.95 REN (0.60) RENCTSBCTSK
SCHEMBL10722990 0.92 REN (0.62) REN
SCHEMBL10722982 0.92 REN (0.62) REN
SCHEMBL10721231 0.91 REN (0.62) RENCTSBCTSK
SCHEMBL10721238 0.91 REN (0.62) RENCTSBCTSK
SCHEMBL10720833 0.91 REN (0.62) RENCTSBCTSK

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0152255-A2 New renin-inhibitory peptides and their use SANKYO COMPANY LIMITED (JP) 1985-08-21 — — EP disclosed
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