SCHEMBL7326504

SCHEMBL7326504

CN[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)C(O)CC(O)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.53
CTSD P07339 1/20 0.42
PGA5 P0DJD9 1/20 0.42
CTSE P14091 1/20 0.42
PGC P20142 1/20 0.42

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
SCHEMBL9354453 0.89 PSEN1 (0.51) REN
SCHEMBL9354447 0.89 PSEN1 (0.51) REN
SCHEMBL7329529 0.89 REN (0.50) RENCTSDPGA5CTSEPGC
SCHEMBL7335538 0.88 REN (0.52) RENCTSDCTSE
SCHEMBL7437602 0.82 REN (0.75) REN
SCHEMBL7394498 0.81 REN (0.46) REN
SCHEMBL7360539 0.81 REN (0.46) REN
SCHEMBL9222943 0.81 REN (0.39) REN
SCHEMBL7325616 0.80 REN (0.68) REN
SCHEMBL10510052 0.80 REN (0.42) RENCTSDCTSE

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-0396065-A1 Novel amino acid derivatives possessing renin-inhibitory activities Japan Tobacco Inc. (JP) 1990-11-07 EP disclosed