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SCHEMBL10725435

SCHEMBL10725435

CCC(C)[C@H](NC(=O)C(Cc1cccnc1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)N[C@H](CO)[C@@H](C)CC

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 9/20 0.52
▸ CTSB P07858 5/20 0.46
▸ CTSK P43235 1/20 0.46
▸ CASP3 P42574 1/20 0.45
▸ CTSL P07711 4/20 0.45
▸ MME P08473 1/20 0.41
▸ ACE P12821 1/20 0.41
▸ CPA1 P15085 1/20 0.41
▸ ACE2 Q9BYF1 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
SCHEMBL10725430 1.00 REN (0.52) RENCTSBCTSKCASP3CTSL
SCHEMBL10724153 0.93 REN (0.52) RENCTSBCTSKCASP3CTSL
SCHEMBL10724146 0.93 REN (0.52) RENCTSBCTSKCASP3CTSL
SCHEMBL10720968 0.92 REN (0.61) RENCTSBCTSK
SCHEMBL10720976 0.92 REN (0.61) RENCTSBCTSK
SCHEMBL10724673 0.90 CTSK (0.56) RENCTSBCTSKCASP3
SCHEMBL10724666 0.90 CTSK (0.56) RENCTSBCTSKCASP3
SCHEMBL10724497 0.89 REN (0.56) RENCTSBCTSKCASP3CTSL
SCHEMBL10724505 0.89 REN (0.56) RENCTSBCTSKCASP3CTSL
SCHEMBL10725407 0.89 REN (0.49) RENCTSBCTSKCASP3CTSL

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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