SCHEMBL8322874

SCHEMBL8322874

CS(=O)(=O)OC1CCCC1NC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.51
ALDH1A1 P00352 2/20 0.49
GAA P10253 1/20 0.49
CTSK P43235 4/20 0.48
CTSB P07858 2/20 0.48
CTSS P25774 2/20 0.48
CASP3 P42574 3/20 0.48
TSHR P16473 1/20 0.47
EPHX1 P07099 1/20 0.47
CTSL P07711 1/20 0.46

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
SCHEMBL28914412 0.85 CPB1 (0.58) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL28914414 0.85 CPB1 (0.58) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL20749075 0.85 CPB1 (0.58) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL19630135 0.85 CPB1 (0.58) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL16683507 0.84 CPB1 (0.47) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL2851278 0.82 CPB1 (0.46) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL26632432 0.82 CPB1 (0.46) CPB1ALDH1A1GAACTSKCASP3
SCHEMBL2851275 0.82 CPB1 (0.46) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL2843716 0.81 CPB1 (0.52) CPB1ALDH1A1GAACTSKCTSB
SCHEMBL4374791 0.81 CPB1 (0.46) CPB1ALDH1A1GAACTSKCTSB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5925624-A ANTIINFLAMMATORY AGENTS TREATING PATIENTS WITH INFLAMMATORY CONDITIONS SUSCEPTIBLE TO LEUKOCYTE-INDUCED TISSUE DAMAGE GLAXO GROUP LIMITED (GB) 1999-07-20 US disclosed
US-5889178-A N-(2,2-DIPHENYLETHYL)-DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-03-30 US disclosed