SCHEMBL7280643

SCHEMBL7280643

CC(C)C[C@H](C(=O)OC(C)(C)C)C(O)C(O)C(N)N1CCSCC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.33
CTSK P43235 1/20 0.30

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
SCHEMBL327357 0.74 PREP (0.40) PREP
SCHEMBL27391716 0.72 NOS1 (0.37) CTSK
SCHEMBL7280649 0.71
SCHEMBL7281120 0.71 NOS1 (0.34)
SCHEMBL19428157 0.70 NOS1 (0.38) CTSK
SCHEMBL25687930 0.67 CA1 (0.42) CTSK
SCHEMBL7762836 0.64 CTSL (0.39) CTSK
SCHEMBL7295011 0.64 ANPEP (0.46) CTSK
SCHEMBL15015766 0.64 CTSL (0.39) CTSK
SCHEMBL7518207 0.64 CTSL (0.39) CTSK

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-0309766-A2 N-acylamino acid derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 EP disclosed