SCHEMBL10724160

SCHEMBL10724160

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

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 2/20 0.49
▸ CTSK P43235 2/20 0.49
▸ REN P00797 6/20 0.47
▸ CASP3 P42574 1/20 0.44
▸ ACE2 Q9BYF1 2/20 0.42
▸ MME P08473 3/20 0.41
▸ ECE1 P42892 2/20 0.41
▸ CTSD P07339 1/20 0.41
▸ CTSL P07711 1/20 0.40
▸ ANPEP P15144 1/20 0.39
▸ ERAP1 Q9NZ08 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ MMP7 P09237 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ MMP14 P50281 1/20 0.39
▸ ACE P12821 1/20 0.39
▸ CPA1 P15085 1/20 0.39
▸ F2 P00734 1/20 0.39

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
SCHEMBL10725349 0.93 CTSK (0.56) CTSBCTSKRENCASP3ACE2
SCHEMBL10720236 0.89 CTSB (0.49) CTSBCTSKRENCASP3ACE2
SCHEMBL10725450 0.87 REN (0.50) CTSBCTSKRENCASP3ACE2
SCHEMBL10722068 0.87 CTSB (0.48) CTSBCTSKRENCASP3ACE2
SCHEMBL10724170 0.81 CTSB (0.49) CTSBCTSKRENCASP3ACE2
SCHEMBL10725341 0.80 REN (0.62) CTSBCTSKRENCASP3CTSD
SCHEMBL10725334 0.80 REN (0.62) CTSBCTSKRENCASP3CTSD
SCHEMBL10720849 0.80 REN (0.57) CTSBCTSKRENCASP3CTSD
SCHEMBL10720856 0.80 REN (0.57) CTSBCTSKRENCASP3CTSD
SCHEMBL10721218 0.79 REN (0.62) CTSBCTSKRENCTSD

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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