SCHEMBL8291338

SCHEMBL8291338

COP(C)(=O)C(C(=O)N/C=C/c1cccc(N)c1)c1csc2ccc(Cl)cc12

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 17/20 0.70
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
CTSG P08311 1/20 0.42
PRSS3 P35030 1/20 0.42
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL1050992 0.90 CMA1 (0.86) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL1050990 0.90 CMA1 (0.86) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL1001756 0.88 CMA1 (0.80) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL1001749 0.88 CMA1 (0.80) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL12315027 0.87 CMA1 (0.71) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL12314992 0.86 CMA1 (0.82) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL8290020 0.83 CMA1 (0.64) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL13008686 0.83 CMA1 (0.86) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL3651044 0.83 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL3651051 0.83 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3

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
WO-2005073214-A2 NOVEL INHIBITORS OF CHYMASE JANSSEN PHARMACEUTICA, N.V. (BE) 2005-08-11 WO disclosed