SCHEMBL10721352

SCHEMBL10721352

CC(C)CC(NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)P(=O)(O)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 2/20 0.52
▸ MME P08473 4/20 0.47
▸ ECE1 P42892 3/20 0.47
▸ CTSB P07858 1/20 0.47
▸ CTSK P43235 1/20 0.47
▸ CASP3 P42574 1/20 0.46
▸ MMP2 P08253 1/20 0.46
▸ MMP7 P09237 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ MMP14 P50281 1/20 0.46
▸ ANPEP P15144 1/20 0.44
▸ ERAP1 Q9NZ08 1/20 0.44
▸ ACE2 Q9BYF1 1/20 0.43
▸ ACE P12821 1/20 0.43
▸ CAPN1 P07384 1/20 0.42

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
SCHEMBL10725013 0.93 REN (0.53) RENMMEECE1CTSBCTSK
SCHEMBL10722606 0.93 REN (0.53) RENMMEECE1CTSBCTSK
SCHEMBL10724261 0.90 ANPEP (0.42) RENMMP2MMP9MMP8ANPEP
SCHEMBL10724555 0.89 REN (0.53) RENMMEECE1CTSBCTSK
SCHEMBL10720793 0.89 REN (0.53) RENMMEECE1CTSBCTSK
SCHEMBL10725310 0.89 REN (0.53) RENMMEECE1CTSBCTSK
SCHEMBL10725220 0.88 REN (0.47) RENMMEECE1CTSBCTSK
SCHEMBL10725225 0.87 REN (0.43) RENMMEECE1CTSBCTSK
SCHEMBL10724617 0.86 REN (0.51) RENMMEECE1CTSBCTSK
SCHEMBL10720911 0.86 REN (0.51) RENMMEECE1CTSBCTSK

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
US-4698329-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1987-10-06 — — US disclosed
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