SCHEMBL10724555

SCHEMBL10724555

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

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 5/20 0.53
▸ CASP3 P42574 1/20 0.48
▸ CTSB P07858 1/20 0.47
▸ CTSK P43235 1/20 0.47
▸ ANPEP P15144 1/20 0.47
▸ ERAP1 Q9NZ08 1/20 0.47
▸ MMP2 P08253 3/20 0.47
▸ MMP9 P14780 3/20 0.47
▸ MMP8 P22894 3/20 0.47
▸ MMP14 P50281 3/20 0.47
▸ MMP7 P09237 1/20 0.47
▸ MME P08473 3/20 0.46
▸ ECE1 P42892 3/20 0.46
▸ ACE2 Q9BYF1 1/20 0.44
▸ MMP3 P08254 1/20 0.43
▸ NMBR P28336 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
SCHEMBL10720793 1.00 REN (0.53) RENCASP3CTSBCTSKANPEP
SCHEMBL10725310 1.00 REN (0.53) RENCASP3CTSBCTSKANPEP
SCHEMBL10724617 0.93 REN (0.51) RENCASP3CTSBCTSKANPEP
SCHEMBL10720911 0.93 REN (0.51) RENCASP3CTSBCTSKANPEP
SCHEMBL10721157 0.91 REN (0.44) RENCASP3ANPEPERAP1MMP2
SCHEMBL10721016 0.91 REN (0.44) RENCASP3ANPEPERAP1MMP2
SCHEMBL10722734 0.90 REN (0.54) RENCASP3CTSBCTSKANPEP
SCHEMBL10725013 0.90 REN (0.53) RENCASP3CTSBCTSKANPEP
SCHEMBL10722606 0.90 REN (0.53) RENCASP3CTSBCTSKANPEP
SCHEMBL10725450 0.89 REN (0.50) RENCASP3CTSBCTSKANPEP

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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