SCHEMBL7274295

SCHEMBL7274295

CN[C@@H](Cc1cn(S(=O)(=O)c2ccc(C)cc2)cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.42
REN P00797 17/20 0.38
TLR2 O60603 1/20 0.35
TLR1 Q15399 1/20 0.35
GCK P35557 1/20 0.35

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
SCHEMBL7287334 0.93 KLK7 (0.41) KLK7REN
SCHEMBL7272612 0.90 REN (0.45) REN
SCHEMBL7280285 0.89 PSEN1 (0.46) KLK7REN
SCHEMBL7285856 0.89 KLK7 (0.39) KLK7REN
SCHEMBL7279531 0.89 REN (0.41) KLK7REN
SCHEMBL7271684 0.88 REN (0.44) KLK7REN
SCHEMBL7282895 0.85 KLK7 (0.42) KLK7RENTLR2TLR1GCK
SCHEMBL7287986 0.79 KLK7 (0.43) KLK7RENTLR2TLR1
SCHEMBL9011568 0.79 REN (0.37) KLK7RENGCK
SCHEMBL7273810 0.78 KLK7 (0.42) KLK7REN

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-0476515-A1 New amino acid derivatives, a process for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-25 EP disclosed