SCHEMBL10443352

SCHEMBL10443352

CC(=O)N(C(=O)[C@@H](N)Cc1ccccc1)[C@](CC(C)C)(C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)NCC(C)C)C1CS(=O)(=O)c2ccc(CN)cc21

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 18/20 0.45
▸ BACE1 P56817 2/20 0.37

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
Hydrochloric Acid SCHEMBL10444050 0.99 REN (0.44) RENBACE1
SCHEMBL10444354 0.95 REN (0.44) RENBACE1
SCHEMBL10443703 0.93 REN (0.49) RENBACE1
SCHEMBL10444098 0.91 REN (0.44) RENBACE1
Water SCHEMBL10443355 0.90 REN (0.44) REN
SCHEMBL10444219 0.90 REN (0.49) RENBACE1
SCHEMBL10444513 0.88 REN (0.41) RENBACE1
SCHEMBL10443629 0.88 REN (0.43) RENBACE1
Hydrochloric Acid SCHEMBL10443811 0.87 REN (0.40) RENBACE1
Water SCHEMBL10443556 0.87 REN (0.42) RENBACE1

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
EP-0350163-A2 Renin inhibitory peptides BEECHAM GROUP PLC (GB) 1990-01-10 — — EP claimed
EP-0350163-A2 Renin inhibitory peptides BEECHAM GROUP PLC (GB) 1990-01-10 — — EP disclosed
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