SCHEMBL9699561

SCHEMBL9699561

CCCS(=O)(=O)NC[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(Cc1ccccc1)CS(=O)(=O)C(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.60

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
SCHEMBL9699381 0.96 REN (0.61) REN
SCHEMBL9698147 0.94 REN (0.62) REN
SCHEMBL9698235 0.94 REN (0.61) REN
SCHEMBL9699268 0.93 REN (0.64) REN
SCHEMBL9699305 0.93 REN (0.50) REN
SCHEMBL9699389 0.92 REN (0.62) REN
Hydrochloric Acid SCHEMBL9699498 0.92 REN (0.62) REN
SCHEMBL9698134 0.92 REN (0.63) REN
SCHEMBL9700585 0.91 REN (0.56) REN
SCHEMBL9700588 0.91 REN (0.56) 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