SCHEMBL7326756

SCHEMBL7326756

CC(C)CC(=O)NC[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCC(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.52

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
SCHEMBL9699460 0.96 REN (0.52) REN
SCHEMBL9699388 0.96 REN (0.52) REN
SCHEMBL7299531 0.90 REN (0.49) REN
SCHEMBL9658139 0.87 REN (0.55) REN
SCHEMBL9700775 0.87 REN (0.50) REN
SCHEMBL9660757 0.86 REN (0.54) REN
SCHEMBL9699238 0.86 REN (0.50) REN
SCHEMBL9699595 0.86 REN (0.50) REN
SCHEMBL7290943 0.85 REN (0.48) REN
SCHEMBL9699202 0.85 REN (0.54) 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-0339483-A2 Renin inhbiting amino-acid derivatives MERCK PATENT GmbH (DE) 1989-11-02 EP disclosed