SCHEMBL9699394

SCHEMBL9699394

CCCS(=O)(=O)NC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(CC(=O)N1CCC(NC(=O)OC(C)(C)C)CC1)Cc1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.49

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
SCHEMBL7300086 0.96 REN (0.49) REN
SCHEMBL7301933 0.93 REN (0.51) REN
SCHEMBL9700503 0.92 REN (0.50) REN
SCHEMBL9699254 0.91 REN (0.58) REN
SCHEMBL7293755 0.86 REN (0.50) REN
SCHEMBL9699256 0.86 REN (0.38) REN
SCHEMBL7299350 0.86 REN (0.57) REN
SCHEMBL9699238 0.86 REN (0.50) REN
SCHEMBL7290908 0.84 REN (0.52) REN
SCHEMBL9698201 0.82 REN (0.59) REN

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
EP-0501280-A2 Renin-inhibiting peptide analogues MERCK PATENT GmbH (DE) 1992-09-02 EP disclosed