SCHEMBL10720722

SCHEMBL10720722

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

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 4/20 0.41
▸ ERAP2 Q6P179 4/20 0.41
▸ ERAP1 Q9NZ08 4/20 0.41
▸ MMP9 P14780 2/20 0.41
▸ MMP8 P22894 2/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ IL1RN P18510 2/20 0.39
▸ LNPEP Q9UIQ6 1/20 0.39
▸ BACE1 P56817 4/20 0.39
▸ CTSD P07339 2/20 0.39
▸ BACE2 Q9Y5Z0 1/20 0.39
▸ REN P00797 2/20 0.38
▸ MMP14 P50281 1/20 0.38

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
SCHEMBL11012642 1.00 ANPEP (0.41) ANPEPERAP2ERAP1MMP9MMP8
SCHEMBL10725310 0.88 REN (0.53) ANPEPERAP1MMP9MMP8MMP2
SCHEMBL10724555 0.88 REN (0.53) ANPEPERAP1MMP9MMP8MMP2
SCHEMBL10720793 0.88 REN (0.53) ANPEPERAP1MMP9MMP8MMP2
SCHEMBL10724261 0.87 ANPEP (0.42) ANPEPERAP2ERAP1MMP9MMP8
Bromide SCHEMBL10976755 0.83 MMP9 (0.45) ANPEPERAP2MMP9MMP8MMP2
Bromide SCHEMBL10635874 0.83 MMP9 (0.45) ANPEPERAP2MMP9MMP8MMP2
SCHEMBL7274793 0.82 REN (0.46) ANPEPERAP2ERAP1MMP9MMP8
SCHEMBL10724617 0.81 REN (0.51) ANPEPERAP1MMP9MMP8MMP2
SCHEMBL10720911 0.81 REN (0.51) ANPEPERAP1MMP9MMP8MMP2

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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