SCHEMBL12432102

SCHEMBL12432102

Bc1cc(Cn2c(=O)n(CCC(=O)O)c3ccccc32)c2c(c1)NC(=O)C2

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 19/20 0.79
CTSG P08311 7/20 0.51

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
SCHEMBL2311999 0.88 CMA1 (1.00) CMA1CTSG
SCHEMBL2313030 0.88 CMA1 (1.00) CMA1CTSG
SCHEMBL12431643 0.82 CMA1 (0.82) CMA1CTSG
SCHEMBL2314069 0.77 CMA1 (0.78) CMA1CTSG
SCHEMBL12431603 0.76 CMA1 (0.55) CMA1CTSG
SCHEMBL12431684 0.74 CMA1 (0.69) CMA1CTSG
SCHEMBL8111095 0.73 CMA1 (0.73) CMA1CTSG
SCHEMBL8122292 0.73 CMA1 (0.86) CMA1CTSG
SCHEMBL11811986 0.72 APEX1 (0.70) CMA1CTSG
SCHEMBL2314701 0.71 CMA1 (1.00) CMA1CTSG

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-2152674-B1 BENZIMIDAZOLONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2011-08-03 EP disclosed